data_2b3w_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2b3w _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.4 t . . . . . 0 N--CA 1.455 -0.201 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -131.12 153.83 48.96 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.657 -176.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.51 136.15 42.2 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 163.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.7 mm-40 . . . . . 0 N--CA 1.466 0.338 0 O-C-N 123.656 0.597 . . . . 0.0 110.538 -173.757 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.6 t60 . . . . . 0 CA--C 1.528 0.123 0 CA-C-O 120.77 0.319 . . . . 0.0 110.432 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -61.53 168.85 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 111.09 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.45 ' O ' ' HB2' ' A' ' 13' ' ' GLN . 4.5 mtt -64.09 -85.5 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.215 -174.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.45 ' HB2' ' O ' ' A' ' 12' ' ' MET . 8.8 tt0 169.89 120.49 0.01 OUTLIER 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.759 -177.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 65.03 26.16 12.62 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.24 0.543 . . . . 0.0 110.509 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.46 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 29.3 m -76.87 110.97 11.92 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.299 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.9 mm -77.35 108.36 10.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.9 mt -95.82 99.32 9.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.764 -177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.75 106.67 18.67 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 173.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -117.47 132.8 56.49 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.036 -175.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -150.48 100.36 2.86 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.773 167.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.9 m 177.89 88.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 O-C-N 124.065 0.853 . . . . 0.0 109.458 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.663 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 1.3 m -79.87 2.63 22.55 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.994 0.426 . . . . 0.0 111.473 -174.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.1 m -91.42 -8.32 48.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.706 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -131.18 -165.5 1.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.305 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -65.7 -26.46 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.364 -172.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -80.38 -2.49 45.75 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.92 0.39 . . . . 0.0 111.034 177.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.663 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -83.26 -16.84 68.19 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.728 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -68.25 -26.64 65.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.071 0.462 . . . . 0.0 110.898 -179.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -69.28 -26.17 64.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.31 178.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.3 m -76.08 126.76 31.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 171.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -60.46 -20.71 60.85 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -76.51 4.71 8.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.116 0.484 . . . . 0.0 111.225 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -66.75 131.46 46.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.749 0.309 . . . . 0.0 110.678 176.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.481 ' HA ' HG23 ' A' ' 46' ' ' THR . . . -80.93 58.83 3.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.198 0.523 . . . . 0.0 111.681 -175.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -102.34 117.64 60.66 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.822 174.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.6 125.14 17.8 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.956 2.438 . . . . 0.0 112.556 -176.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.737 HG23 ' HA ' ' A' ' 104' ' ' LYS . 29.5 pt -114.4 139.34 40.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.299 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -102.54 105.09 15.55 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.431 HG23 ' CB ' ' A' ' 103' ' ' ALA . 4.0 t -128.57 123.12 58.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.263 -173.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 59.21 27.21 16.16 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.191 174.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.61 -5.62 57.01 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.563 -0.827 . . . . 0.0 113.433 175.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.502 ' HD3' ' HD2' ' A' ' 66' ' ' ARG . 60.9 mttm -124.05 156.9 35.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 117.596 0.698 . . . . 0.0 111.373 -178.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.1 m -100.54 117.04 33.88 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.266 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.488 ' HB2' HG13 ' A' ' 37' ' ' ILE . 41.1 m95 -105.86 133.92 19.98 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.431 -179.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 43.8 Cg_exo -58.43 -41.27 67.17 Favored 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 122.66 2.24 . . . . 0.0 112.752 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.481 HG23 ' HA ' ' A' ' 34' ' ' ALA . 77.9 p -148.24 172.14 14.82 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -33.49 75.18 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -177.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 48' ' ' GLU . 3.6 mp0 -61.3 -28.55 69.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.947 0.403 . . . . 0.0 110.904 -177.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.442 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 57.1 m80 -65.91 -48.01 72.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.401 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -72.75 -35.99 67.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.335 0.588 . . . . 0.0 109.758 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -59.58 -49.1 79.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.028 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.418 ' HA ' ' CB ' ' A' ' 55' ' ' LYS . 37.2 mt-30 -85.97 -13.31 48.02 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.682 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.471 ' HB3' ' HG3' ' A' ' 62' ' ' ARG . . . -69.43 -30.43 68.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.26 0.552 . . . . 0.0 109.961 173.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -90.8 -21.76 21.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.649 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.418 ' CB ' ' HA ' ' A' ' 52' ' ' GLN . 83.0 tttt -58.12 -53.31 59.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.2 0.524 . . . . 0.0 110.606 176.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -91.56 142.05 28.05 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.75 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.679 HD21 ' H ' ' A' ' 57' ' ' LEU . 2.4 pt? -98.5 10.13 41.62 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 173.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -67.51 112.34 4.63 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.762 174.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -50.98 -61.82 1.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.022 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -77.16 -18.27 57.96 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.866 -171.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.531 ' O ' HG13 ' A' ' 65' ' ' ILE . 3.9 t80 -80.58 -35.64 33.95 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.471 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 33.5 ttm180 -59.21 -44.44 92.26 Favored 'General case' 0 CA--C 1.521 -0.144 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 173.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.42 -39.72 76.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.495 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.438 ' CD ' HH21 ' A' ' 67' ' ' ARG . 7.8 tp10 -63.0 -49.24 75.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.916 0.389 . . . . 0.0 110.682 177.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 61' ' ' TYR . 3.5 mt -70.19 -22.78 24.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.185 0.517 . . . . 0.0 110.877 -177.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.502 ' HD2' ' HD3' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -78.46 -29.27 46.77 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.211 176.891 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.438 HH21 ' CD ' ' A' ' 64' ' ' GLU . 56.5 ttp180 -86.02 -35.44 20.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.638 -175.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.4 p -65.43 117.4 6.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.474 0.654 . . . . 0.0 111.22 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.2 m -77.14 -33.72 56.66 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.593 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.3 m -66.24 126.55 92.2 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.335 -178.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.442 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 54.4 Cg_endo -71.86 -40.64 2.56 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.828 2.352 . . . . 0.0 113.281 -179.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 87.0 mtp -70.29 -29.8 66.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.745 0.307 . . . . 0.0 110.74 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.513 ' O ' ' HG3' ' A' ' 77' ' ' MET . 99.6 t -66.74 -39.51 83.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.558 178.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.476 ' HA ' ' HE3' ' A' ' 77' ' ' MET . . . -61.36 -39.36 90.33 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 120.92 0.391 . . . . 0.0 110.369 177.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.64 -38.27 80.34 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.711 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -65.97 -57.36 8.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.954 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.513 ' HG3' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -83.26 -13.04 56.08 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.319 -0.553 . . . . 0.0 111.159 -176.58 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.34 -10.33 60.87 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.644 -0.788 . . . . 0.0 111.607 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.72 -40.46 66.09 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 122.742 0.417 . . . . 0.0 111.647 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.437 ' OD2' ' HG3' ' A' ' 83' ' ' LYS . 30.3 t70 -59.73 137.47 58.03 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.015 -170.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 87.1 mtm-85 -116.96 18.54 14.67 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.059 176.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.4 m -90.91 -28.96 17.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.663 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.439 ' NZ ' ' HB3' ' A' ' 83' ' ' LYS . 6.1 mtpm? -63.31 156.69 68.26 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.257 176.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.05 113.62 1.66 Allowed 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.43 2.087 . . . . 0.0 111.786 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 67.0 mt -101.04 163.75 12.14 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.485 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.422 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 23.6 mtp180 -67.26 139.27 57.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.842 0.353 . . . . 0.0 110.446 176.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 43.2 mtpt -60.64 -28.41 68.54 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.495 0.664 . . . . 0.0 110.604 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -104.07 12.96 33.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.413 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.476 ' HA ' HG23 ' A' ' 92' ' ' VAL . 50.3 t-105 -59.98 -33.65 72.24 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.534 -176.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.647 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 18.3 mm-40 -65.65 -24.32 67.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.398 -179.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.3 t -99.68 -44.78 5.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.299 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.476 HG23 ' HA ' ' A' ' 89' ' ' TRP . 33.7 m -73.96 3.01 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -170.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.647 ' NZ ' ' HA ' ' A' ' 90' ' ' GLU . 56.7 mttp -56.79 -42.35 79.32 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 175.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.477 ' O ' ' HB2' ' A' ' 98' ' ' ARG . 52.1 mt-10 -61.13 -39.5 90.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.833 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -69.19 -50.88 43.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.368 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 59.6 t -63.78 -49.37 82.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.776 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.487 ' SD ' HD13 ' A' ' 145' ' ' LEU . 50.7 ttm -66.2 -36.06 82.08 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.335 -177.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.477 ' HB2' ' O ' ' A' ' 94' ' ' GLU . 20.3 ttt180 -61.31 -43.16 99.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.832 0.349 . . . . 0.0 110.664 -179.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -70.51 -35.34 73.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.572 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.88 88.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.732 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 145' ' ' LEU . 94.0 mt -64.46 -40.3 95.44 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.53 176.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.481 ' O ' ' HB2' ' A' ' 106' ' ' GLU . 34.2 ttm180 -54.17 -54.46 39.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.1 175.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.431 ' CB ' HG23 ' A' ' 39' ' ' VAL . . . -62.05 -34.43 76.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.457 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.737 ' HA ' HG23 ' A' ' 37' ' ' ILE . 64.4 tttm -63.96 -56.1 17.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.249 -178.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 71.2 m-85 -78.38 -28.0 46.96 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -175.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.481 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -79.02 -40.58 31.04 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.09 -177.464 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -69.61 -14.67 62.95 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.05 0.452 . . . . 0.0 110.884 -176.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -124.98 105.97 9.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.359 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -56.67 -31.43 64.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.96 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.05 -47.41 81.03 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.964 177.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 36.0 mt -74.49 -39.85 62.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.763 -175.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.574 ' HG3' HD11 ' A' ' 156' ' ' LEU . 61.9 ttt180 -59.12 -48.45 81.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.451 178.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.8 -35.14 80.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.553 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 62.2 tp -64.61 -37.15 86.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.61 176.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.483 ' HG ' ' HB2' ' A' ' 153' ' ' ARG . 16.5 tp -64.02 -50.52 68.14 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.099 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.477 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 4.6 mp -67.44 -19.71 65.4 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.82 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -67.67 -30.15 69.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.511 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.439 ' HB ' HD22 ' A' ' 123' ' ' LEU . 70.0 p -81.3 -0.46 41.06 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 120.758 0.313 . . . . 0.0 111.683 -177.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.518 ' HB1' ' HD2' ' A' ' 153' ' ' ARG . . . -86.33 139.94 34.17 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 170.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -99.11 74.67 0.14 OUTLIER 'Cis proline' 0 N--CA 1.454 -0.799 0 C-N-CA 124.468 -1.055 . . . . 0.0 113.291 -0.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.46 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -111.0 176.4 5.04 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -120.83 120.53 35.83 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.996 0.426 . . . . 0.0 110.272 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.439 HD22 ' HB ' ' A' ' 118' ' ' THR . 9.1 mt -86.32 125.85 33.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.787 -173.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.2 t -130.83 116.85 35.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.845 0.355 . . . . 0.0 110.925 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -79.99 130.48 35.31 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 175.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.622 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 10.6 t60 -125.64 77.47 1.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.188 0.518 . . . . 0.0 109.613 -173.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 5.0 t -87.2 114.23 23.63 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.543 0.687 . . . . 0.0 109.319 175.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.706 ' OE2' ' HA3' ' A' ' 137' ' ' GLY . 5.6 tp10 -82.17 41.32 0.67 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.616 0.722 . . . . 0.0 109.378 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -143.06 -75.79 0.26 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.375 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -118.42 95.35 4.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.068 -174.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.35 86.08 2.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.165 -177.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.45 ' C ' ' H ' ' A' ' 134' ' ' GLY . 28.7 t80 -151.08 122.06 7.65 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.591 ' O ' ' HB3' ' A' ' 145' ' ' LEU . 71.3 m95 74.73 -10.34 1.2 Allowed 'General case' 0 N--CA 1.474 0.737 0 O-C-N 124.016 0.823 . . . . 0.0 110.585 -171.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.563 ' O ' ' HA3' ' A' ' 141' ' ' GLY . . . -137.79 136.99 8.54 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 108.196 -1.962 . . . . 0.0 108.196 176.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 143' ' ' ASN . 1.4 t70 -68.82 1.77 3.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.697 0.749 . . . . 0.0 112.109 -166.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 68.85 -164.53 49.32 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.933 175.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.706 ' HA3' ' OE2' ' A' ' 128' ' ' GLU . . . -89.98 -17.02 55.13 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.924 178.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -99.63 -16.92 18.05 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 89.08 62.07 1.38 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.118 -1.039 . . . . 0.0 112.468 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 56.4 tttm 176.84 65.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 176.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.563 ' HA3' ' O ' ' A' ' 134' ' ' GLY . . . -124.67 4.62 8.61 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.176 -1.012 . . . . 0.0 113.441 -173.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.485 ' C ' ' H ' ' A' ' 144' ' ' ARG . 55.0 mttp 64.19 53.71 1.73 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.122 0.486 . . . . 0.0 109.895 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.56 ' HB2' ' HB2' ' A' ' 135' ' ' ASP . 7.4 t30 -57.15 5.1 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.368 1.467 . . . . 0.0 113.791 -177.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.519 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 57.9 mtm180 -51.84 -13.28 0.26 Allowed 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.591 ' HB3' ' O ' ' A' ' 133' ' ' TRP . 25.4 tp -60.57 -49.84 75.94 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 171.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.637 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -62.92 -33.03 85.98 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.555 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -68.82 -41.21 78.93 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 121.165 -0.214 . . . . 0.0 110.638 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 88.7 mt -58.05 -37.13 73.82 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.83 -38.07 89.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.914 175.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.637 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 38.5 mtt -66.35 -50.28 64.08 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.183 0.516 . . . . 0.0 110.189 178.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . 0.489 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 23.0 tt0 -69.38 -35.95 76.31 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.608 -176.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 102' ' ' ARG . 50.9 tp -62.07 -43.92 97.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.041 0.448 . . . . 0.0 109.859 174.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.518 ' HD2' ' HB1' ' A' ' 119' ' ' ALA . 47.5 ttp85 -55.51 -41.54 73.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.969 176.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . 0.5 ' O ' HG13 ' A' ' 158' ' ' ILE . 31.6 tt0 -68.36 -34.71 76.57 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.684 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 151' ' ' GLU . 15.3 mt-30 -65.35 -41.85 93.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.068 0.461 . . . . 0.0 109.858 176.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.574 HD11 ' HG3' ' A' ' 112' ' ' ARG . 94.3 mt -67.27 -28.88 68.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.086 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -69.44 -40.95 76.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.453 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 154' ' ' GLU . 76.2 mt -60.63 -46.06 96.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.669 0.271 . . . . 0.0 110.474 178.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . 0.481 ' CD ' HH22 ' A' ' 112' ' ' ARG . 0.2 OUTLIER -61.3 -38.45 86.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.07 0.462 . . . . 0.0 110.088 177.381 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -70.33 -33.31 71.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.477 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 4.6 mp -68.63 -10.62 57.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.132 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.426 174.988 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.707 HG22 ' H ' ' A' ' 5' ' ' ALA . 2.5 p . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.501 0.191 . . . . 0.0 110.926 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.647 ' H ' HG13 ' A' ' 3' ' ' VAL . 7.2 tpp85 56.84 25.73 10.73 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.74 0.781 . . . . 0.0 111.586 178.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.707 ' H ' HG22 ' A' ' 3' ' ' VAL . . . -69.32 127.87 34.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 173.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 . . . . . 0 C--N 1.324 -0.515 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.946 -176.145 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.8 p-80 . . . . . 0 CA--C 1.517 -0.292 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.689 HG23 ' HD2' ' A' ' 120' ' ' PRO . 34.1 m -93.74 175.19 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 174.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 51.4 mtm -108.95 37.22 2.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.312 -178.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 63.83 102.56 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.952 -178.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.3 t70 49.95 79.84 0.08 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.528 -175.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.8 m -103.66 127.41 51.1 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.713 -178.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 48.5 mt -96.67 107.13 19.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 CA-C-O 121.446 0.641 . . . . 0.0 110.074 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -89.89 96.96 6.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.24 -176.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.503 HD21 ' HB ' ' A' ' 124' ' ' VAL . 12.7 m120 -83.51 101.34 11.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.362 174.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 125' ' ' GLU . 52.5 p90 -116.19 148.93 39.89 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.781 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 126' ' ' HIS . 34.9 t80 -150.23 150.3 31.38 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.388 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 96.1 p 62.48 159.52 0.07 Allowed 'General case' 0 C--O 1.231 0.113 0 O-C-N 124.867 1.354 . . . . 0.0 111.661 177.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.471 HG23 ' HA ' ' A' ' 33' ' ' ALA . 7.8 p -83.14 -65.99 0.94 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.528 175.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.1 t 61.41 -78.88 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.205 0 O-C-N 124.135 0.897 . . . . 0.0 111.625 176.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -105.9 -169.08 1.53 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.901 0.381 . . . . 0.0 110.117 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -66.02 -31.93 73.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.749 -174.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -75.99 -1.59 26.44 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.309 0.576 . . . . 0.0 111.187 -175.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.46 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -68.53 -0.32 16.93 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.109 174.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -52.36 -32.47 38.55 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.602 0.761 . . . . 0.0 112.642 -177.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -60.1 -36.49 77.53 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.7 t -59.97 148.86 33.74 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.133 0.492 . . . . 0.0 111.04 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -74.5 -14.64 60.84 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.096 0.474 . . . . 0.0 109.928 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -96.84 7.9 45.57 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.31 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.471 ' HA ' HG23 ' A' ' 22' ' ' THR . . . -70.69 136.06 48.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.715 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -83.12 64.6 7.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.608 0.718 . . . . 0.0 110.939 -174.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.405 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 70.4 m95 -108.86 120.97 44.46 Favored Pre-proline 0 C--N 1.314 -0.957 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.048 172.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 34.5 Cg_exo -60.49 133.45 48.97 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.985 2.457 . . . . 0.0 112.518 -177.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.469 HD11 ' HA ' ' A' ' 47' ' ' SER . 39.0 pt -118.81 147.91 22.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.967 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -109.04 98.62 8.06 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.401 ' CG1' ' HE2' ' A' ' 99' ' ' LYS . 21.2 t -122.02 120.37 61.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.913 -174.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 61.57 27.8 17.19 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.593 0.558 . . . . 0.0 110.629 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.39 0.57 90.12 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 121.034 -0.603 . . . . 0.0 112.462 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -104.63 144.4 31.76 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -177.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.1 m -105.29 109.07 20.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.924 0.392 . . . . 0.0 110.674 -175.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -102.05 143.84 27.41 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.713 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.24 -30.48 93.07 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.939 2.426 . . . . 0.0 112.248 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.733 HG23 ' OE1' ' A' ' 48' ' ' GLU . 2.3 t -170.76 -179.93 3.01 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.882 177.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.469 ' HA ' HD11 ' A' ' 37' ' ' ILE . 20.3 m -66.62 -39.62 88.41 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 113.369 0.878 . . . . 0.0 113.369 -166.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.733 ' OE1' HG23 ' A' ' 46' ' ' THR . 0.6 OUTLIER -63.15 -33.99 76.65 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.498 -171.954 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -56.01 -42.99 77.3 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.609 0.242 . . . . 0.0 111.072 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -71.46 -39.63 70.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.99 0.424 . . . . 0.0 110.24 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -60.63 -38.37 84.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.151 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.1 mm100 -72.87 -46.47 52.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.424 177.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.663 ' HB3' ' HG3' ' A' ' 62' ' ' ARG . . . -61.4 -42.18 98.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.705 -179.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -84.8 -13.66 50.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.764 -176.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.823 ' HZ1' ' HB2' ' A' ' 55' ' ' LYS . 4.8 ttmp? -64.35 -53.14 53.31 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.86 0.362 . . . . 0.0 110.612 173.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.436 ' HE1' ' HB2' ' A' ' 83' ' ' LYS . 92.9 m-85 -80.66 160.22 25.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.12 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.456 HD13 ' HB3' ' A' ' 86' ' ' ARG . 5.5 mp -98.89 -28.84 13.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.645 177.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -58.85 120.57 9.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.06 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -68.72 -37.45 79.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -61.27 -42.74 99.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.417 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.417 ' O ' HG13 ' A' ' 65' ' ' ILE . 0.2 OUTLIER -74.14 -37.28 64.09 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.68 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.663 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 40.5 ttm180 -62.58 -41.56 99.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.397 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.527 ' HG2' ' NH1' ' A' ' 67' ' ' ARG . 16.5 tt0 -71.04 -26.93 63.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.025 178.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -68.09 -40.46 82.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.851 175.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.495 HG12 ' SD ' ' A' ' 77' ' ' MET . 56.6 mt -71.89 -18.52 19.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.283 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -75.38 -24.65 57.27 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.527 ' NH1' ' HG2' ' A' ' 63' ' ' GLU . 35.8 mmt-85 -73.37 -36.08 66.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.999 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.449 HG23 ' HB ' ' A' ' 73' ' ' VAL . 14.9 p -75.39 125.39 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.638 0.733 . . . . 0.0 112.038 -171.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.2 p -91.4 -38.78 12.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.392 176.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 20.0 m -72.57 121.04 83.84 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.513 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -52.52 -46.29 34.23 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.658 2.906 . . . . 0.0 113.519 179.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 85.1 mtp -63.81 -31.36 72.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.322 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.449 ' HB ' HG23 ' A' ' 68' ' ' VAL . 43.2 t -75.98 -32.29 23.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.808 0.337 . . . . 0.0 110.244 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.62 99.51 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.265 0.555 . . . . 0.0 110.462 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.23 -39.51 86.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.09 175.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -34.62 72.03 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.899 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.495 ' SD ' HG12 ' A' ' 65' ' ' ILE . 64.2 mtt -64.73 -55.04 22.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.061 0.458 . . . . 0.0 110.653 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.22 11.59 60.37 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.047 -0.597 . . . . 0.0 113.007 -176.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.54 -15.73 63.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.074 0.464 . . . . 0.0 110.372 174.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -107.18 114.03 27.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.439 177.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.618 ' HB2' HD12 ' A' ' 85' ' ' LEU . 26.1 ptt180 -101.16 24.93 8.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.783 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.4 m -81.08 -9.96 59.74 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.662 0.744 . . . . 0.0 109.223 174.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.436 ' HB2' ' HE1' ' A' ' 56' ' ' PHE . 46.8 mmtm -80.59 166.29 40.5 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.864 177.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -56.31 108.36 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.466 2.111 . . . . 0.0 113.126 -177.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.618 HD12 ' HB2' ' A' ' 81' ' ' ARG . 92.7 mt -91.8 148.85 21.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.824 175.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.456 ' HB3' HD13 ' A' ' 57' ' ' LEU . 11.6 ptp180 -84.26 150.01 25.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.04 0.448 . . . . 0.0 111.519 -175.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -75.27 -25.45 58.02 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.997 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -90.92 9.94 28.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.835 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.416 ' HB2' ' HG3' ' A' ' 86' ' ' ARG . 58.0 t-105 -56.27 -47.6 78.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.756 -174.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.4 -16.52 64.15 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -177.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.4 m -99.6 -30.45 12.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.89 0.376 . . . . 0.0 111.285 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 29.7 m -93.0 -0.08 10.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.668 0.27 . . . . 0.0 110.7 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.483 ' HB3' ' HZ1' ' A' ' 93' ' ' LYS . 7.0 ttpm? -55.39 -57.95 9.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.195 0.522 . . . . 0.0 110.554 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -64.63 -40.62 95.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.984 177.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.49 -53.65 48.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.566 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 45.1 t -60.18 -49.27 84.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.072 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.1 tpt -65.94 -38.91 89.83 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.908 -174.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.504 ' HD3' HD22 ' A' ' 148' ' ' LEU . 31.8 mtm180 -73.5 -22.63 60.09 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.444 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.401 ' HE2' ' CG1' ' A' ' 39' ' ' VAL . 86.9 tttt -72.97 -38.37 66.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.015 0.436 . . . . 0.0 109.858 176.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.77 -42.38 67.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.473 176.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.453 HD21 HD22 ' A' ' 149' ' ' LEU . 61.7 mt -63.13 -42.98 99.6 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.008 177.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 102' ' ' ARG . 40.7 ttm180 -52.35 -53.0 50.3 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.768 175.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.416 ' CB ' ' HB ' ' A' ' 37' ' ' ILE . . . -55.36 -43.62 75.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.002 -176.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -63.0 -52.14 64.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.685 0.279 . . . . 0.0 111.013 -176.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -77.37 -28.59 52.93 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -79.64 -46.21 17.62 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 122.248 -0.282 . . . . 0.0 111.15 -175.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -66.58 -38.95 88.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.88 0.371 . . . . 0.0 110.767 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -101.96 100.27 10.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.437 178.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.92 -22.64 65.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.106 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.48 -49.58 74.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.909 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 51.3 mt -74.71 -33.93 62.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.953 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.4 ttt180 -54.35 -51.14 65.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.274 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.7 -36.61 80.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.873 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.3 tp -65.23 -41.01 94.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.579 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.73 ' HG ' ' HB2' ' A' ' 153' ' ' ARG . 47.2 tp -63.78 -33.65 76.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.539 177.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.3 mt -81.19 -14.98 57.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.148 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.91 -30.51 21.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.182 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 18.1 p -72.36 -25.92 61.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.152 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.419 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -40.67 132.62 1.75 Allowed Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.147 173.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . 0.689 ' HD2' HG23 ' A' ' 11' ' ' VAL . 28.2 Cg_endo -101.15 31.27 10.14 Favored 'Cis proline' 0 N--CA 1.459 -0.528 0 C-N-CA 124.702 -0.957 . . . . 0.0 112.807 -1.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -60.01 141.84 54.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.902 0.382 . . . . 0.0 111.658 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.5 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 17.3 ttpt -84.62 113.89 21.59 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.98 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 41.5 mt -81.47 116.88 21.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.776 -175.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.503 ' HB ' HD21 ' A' ' 18' ' ' ASN . 89.1 t -128.88 116.72 42.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.732 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.439 ' HA ' ' O ' ' A' ' 19' ' ' PHE . 37.0 tt0 -88.13 128.39 35.43 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.485 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 8.0 t60 -97.05 77.2 2.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.488 0.661 . . . . 0.0 110.223 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.4 m -104.49 101.02 10.7 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.94 -177.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.405 ' HG3' ' HA3' ' A' ' 137' ' ' GLY . 34.9 tt0 -84.98 -43.48 13.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.556 -173.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -62.68 -52.88 61.55 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -103.68 100.56 10.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.519 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.489 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -77.74 85.52 4.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.967 0.413 . . . . 0.0 110.391 178.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.403 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 5.4 t80 -170.03 118.79 0.59 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.685 ' HB3' HD21 ' A' ' 145' ' ' LEU . 3.7 m95 71.37 10.6 6.64 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.782 0.676 . . . . 0.0 111.571 -178.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -136.45 -153.89 6.65 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.389 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.485 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 2.1 p-10 -91.52 -13.54 31.95 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.345 0.593 . . . . 0.0 109.846 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . 0.489 ' HA2' ' HA ' ' A' ' 131' ' ' ALA . . . 77.06 -0.15 67.99 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.171 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.405 ' HA3' ' HG3' ' A' ' 128' ' ' GLU . . . 81.25 15.93 75.48 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.361 -0.447 . . . . 0.0 112.719 -177.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -168.1 -24.79 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -177.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 141.49 -49.65 0.76 Allowed Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.256 -0.973 . . . . 0.0 112.499 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -82.94 62.76 6.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.33 0.586 . . . . 0.0 110.126 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.18 8.62 9.03 Favored Glycine 0 C--N 1.315 -0.616 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.787 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 49.9 mttp 62.48 63.67 1.0 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 122.509 0.323 . . . . 0.0 111.228 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.419 ' OD1' HG11 ' A' ' 124' ' ' VAL . 6.4 t30 -72.66 5.16 3.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.96 0.41 . . . . 0.0 111.304 -177.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.623 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 44.7 ttm180 -47.6 -25.91 1.3 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.761 177.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.685 HD21 ' HB3' ' A' ' 133' ' ' TRP . 20.4 tp -53.9 -47.17 71.43 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.857 0.36 . . . . 0.0 110.391 175.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -62.93 -36.05 92.89 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.96 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . 0.47 ' HA ' ' HE3' ' A' ' 150' ' ' MET . 86.4 t80 -67.08 -41.3 86.57 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 176.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 82.1 mt -61.1 -40.23 92.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.235 -0.439 . . . . 0.0 109.93 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.453 HD22 HD21 ' A' ' 101' ' ' LEU . 96.1 mt -60.06 -46.86 88.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.53 174.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.5 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 74.2 mtm -67.5 -39.54 85.17 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.798 -178.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -70.71 -35.62 72.84 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.529 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 54.9 tp -61.95 -45.77 92.24 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 173.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.73 ' HB2' ' HG ' ' A' ' 115' ' ' LEU . 0.6 OUTLIER -52.01 -42.46 63.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.877 175.461 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -62.03 -38.24 87.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.732 -177.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -73.48 -38.72 65.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.845 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 41.0 mt -67.09 -23.28 65.83 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.084 0.468 . . . . 0.0 110.715 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.32 72.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.218 173.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.56 -33.54 64.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.699 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.25 -49.65 63.63 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.36 0.6 . . . . 0.0 110.97 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 13.7 mttp -87.06 -20.83 26.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.296 -176.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 11.5 tp -63.7 -27.9 69.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.34 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 . . . . . 0 C--N 1.331 -0.197 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.803 179.993 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.452 -0.337 0 N-CA-C 110.564 -0.162 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 65.89 -81.13 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.957 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 61.1 90.77 0.06 Allowed 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.946 0.779 . . . . 0.0 111.919 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.487 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 12.5 mm-40 . . . . . 0 C--N 1.324 -0.517 0 CA-C-O 121.336 0.589 . . . . 0.0 111.127 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 N--CA 1.468 0.473 0 CA-C-O 121.18 0.514 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.469 HG13 ' HB2' ' A' ' 121' ' ' ALA . 28.3 m -129.25 -174.41 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.631 173.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.2 mmt -93.71 -74.26 0.54 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.17 0.509 . . . . 0.0 110.463 -173.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -176.48 121.83 0.15 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.929 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.6 t70 54.33 39.95 31.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.792 0.806 . . . . 0.0 110.055 -176.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.4 m -76.31 140.66 41.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.139 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.406 HG12 ' HB3' ' A' ' 122' ' ' LYS . 61.2 mt -115.62 121.51 67.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.4 mt -103.88 111.0 31.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.001 -175.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.607 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 8.5 m120 -87.88 101.34 13.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.968 173.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.49 ' CD1' ' HB2' ' A' ' 29' ' ' PHE . 42.6 p90 -101.24 128.54 47.31 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.996 0.426 . . . . 0.0 110.962 -178.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -150.57 -179.19 7.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 173.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.0 m 71.3 84.82 0.13 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.638 0.732 . . . . 0.0 110.658 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.92 -9.82 58.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.233 -175.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.5 m -99.4 3.02 45.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.737 0.304 . . . . 0.0 110.855 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -93.35 -84.83 0.29 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.339 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -171.81 -46.6 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.595 0.236 . . . . 0.0 111.072 174.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -84.18 -4.8 59.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.366 0.603 . . . . 0.0 110.605 -174.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -79.13 -0.3 82.17 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.734 -0.667 . . . . 0.0 112.274 177.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -51.28 -33.5 28.88 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -177.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.49 ' HB2' ' CD1' ' A' ' 19' ' ' PHE . 89.0 m-85 -56.98 -19.07 16.12 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -176.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.3 t -75.45 147.71 39.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.197 0.522 . . . . 0.0 110.45 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -73.27 -10.03 59.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.214 -176.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -90.15 8.35 33.36 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.408 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.35 139.22 55.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.163 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.504 ' HA ' HG21 ' A' ' 46' ' ' THR . . . -82.67 57.35 3.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.599 -176.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.428 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 76.1 m95 -118.32 115.92 35.74 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.493 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 35' ' ' TRP . 19.4 Cg_endo -60.48 136.61 68.68 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.996 2.464 . . . . 0.0 112.386 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.545 HG22 ' HA ' ' A' ' 104' ' ' LYS . 24.4 pt -123.8 176.43 5.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.053 -178.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 42.2 tptt -131.4 100.37 5.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.3 t -119.01 130.06 74.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.936 -174.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 62.8 9.52 3.69 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 124.044 0.84 . . . . 0.0 111.362 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.94 4.02 42.11 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.82 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -120.21 146.17 46.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 117.188 0.494 . . . . 0.0 110.952 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.1 m -79.17 131.67 36.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.303 176.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.425 ' HB2' HG13 ' A' ' 37' ' ' ILE . 86.8 m95 -122.46 137.26 27.48 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 176.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.44 -36.55 98.76 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.672 2.248 . . . . 0.0 112.437 -178.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.504 HG21 ' HA ' ' A' ' 34' ' ' ALA . 81.0 p -148.18 174.16 12.26 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.3 m -72.85 -28.42 62.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.307 0.575 . . . . 0.0 109.913 174.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.527 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -68.47 -36.09 78.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.256 -179.706 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.436 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 34.4 m80 -62.37 -36.39 82.12 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.407 0.146 . . . . 0.0 111.31 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -72.57 -37.85 68.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.014 0.435 . . . . 0.0 109.952 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -62.42 -47.62 83.28 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.726 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.569 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 64.6 mm-40 -64.72 -44.88 88.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.363 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.424 ' HB3' ' HG3' ' A' ' 62' ' ' ARG . . . -60.41 -36.54 78.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.305 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -71.26 -29.4 65.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.573 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.6 ' HB2' ' CZ2' ' A' ' 89' ' ' TRP . 75.3 tttt -65.37 -43.64 90.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.787 176.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.73 ' HE1' ' HG3' ' A' ' 83' ' ' LYS . 75.5 m-85 -73.64 109.85 7.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.752 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.497 HD13 ' HB3' ' A' ' 86' ' ' ARG . 11.2 mp -85.3 34.6 0.57 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.811 0.815 . . . . 0.0 108.983 168.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.46 ' H ' ' C ' ' A' ' 56' ' ' PHE . 9.9 t0 -116.59 111.02 19.3 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.387 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -55.08 -56.14 23.2 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -171.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' A' ' 60' ' ' LYS . 4.3 mptp? -72.4 -26.39 61.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.603 0.239 . . . . 0.0 111.489 -176.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.549 ' O ' HG12 ' A' ' 65' ' ' ILE . 0.4 OUTLIER -74.5 -37.93 62.99 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 178.044 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.424 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 40.0 ttm180 -61.76 -40.78 96.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.182 0.515 . . . . 0.0 109.958 175.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.39 -39.7 94.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.723 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -64.2 -37.87 89.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.547 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 61' ' ' TYR . 44.5 mm -65.42 -35.2 74.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.863 0.363 . . . . 0.0 111.042 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.04 -22.45 52.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.268 0.556 . . . . 0.0 109.562 176.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -79.11 -18.8 52.61 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.417 -176.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.9 m -93.76 131.12 41.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.345 0.593 . . . . 0.0 110.726 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.2 p -88.0 -18.88 28.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.287 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.402 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 42.0 t -80.89 124.49 81.48 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.928 -177.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.436 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 18.5 Cg_exo -68.15 -39.81 9.83 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.236 2.624 . . . . 0.0 111.992 177.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.9 tpt -65.57 -35.35 80.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.757 -176.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.642 ' O ' ' HG2' ' A' ' 77' ' ' MET . 92.8 t -66.98 -44.15 88.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.392 178.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.39 -40.03 85.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.947 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.77 -37.79 85.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.8 0.334 . . . . 0.0 110.429 175.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -64.13 -37.9 89.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.302 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.642 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 6.7 mmt -60.31 -57.13 14.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.5 0.667 . . . . 0.0 109.973 176.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.569 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -80.5 3.08 75.35 Favored Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.121 -0.945 . . . . 0.0 113.346 -174.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -80.2 -19.54 46.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 117.088 0.444 . . . . 0.0 110.1 175.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -79.08 172.56 13.64 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.894 0.378 . . . . 0.0 110.001 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -134.14 1.69 3.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.949 0.404 . . . . 0.0 110.321 -176.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.6 p -88.24 -5.16 58.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.96 0.41 . . . . 0.0 111.58 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.794 ' HE3' ' HD2' ' A' ' 84' ' ' PRO . 30.4 mmmt -89.96 151.54 45.34 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.751 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.794 ' HD2' ' HE3' ' A' ' 83' ' ' LYS . 18.9 Cg_endo -57.19 119.01 5.99 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.286 2.658 . . . . 0.0 113.182 -177.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.578 HD23 ' HE3' ' A' ' 55' ' ' LYS . 57.8 mt -107.18 169.02 8.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.186 178.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.535 ' HG2' ' HB2' ' A' ' 89' ' ' TRP . 12.7 ptm180 -100.28 175.95 5.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.822 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -60.11 -69.31 0.22 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.253 -171.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -97.38 36.38 1.48 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.792 0.33 . . . . 0.0 111.108 -176.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.6 ' CZ2' ' HB2' ' A' ' 55' ' ' LYS . 33.3 t-105 -58.66 -35.13 72.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.859 0.361 . . . . 0.0 111.75 -178.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -73.5 -16.99 61.27 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.295 -177.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.9 m -99.69 -37.54 9.07 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.877 0.37 . . . . 0.0 111.282 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m -85.81 3.01 4.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -172.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 59.0 mttp -55.11 -46.49 75.57 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.061 0.458 . . . . 0.0 111.5 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.406 ' H ' ' HG2' ' A' ' 94' ' ' GLU . 3.9 pt-20 -68.06 -25.43 65.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.348 -177.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -75.03 -43.81 51.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.906 0.384 . . . . 0.0 110.117 176.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.16 -47.33 94.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.643 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.8 mtt -65.94 -32.94 74.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.492 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.664 HH21 HD23 ' A' ' 148' ' ' LEU . 27.7 ttm180 -60.87 -43.87 97.82 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.842 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -69.51 -40.49 76.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.76 0.314 . . . . 0.0 110.543 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.1 -47.64 76.48 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.412 HD12 HD23 ' A' ' 149' ' ' LEU . 69.9 mt -66.8 -37.04 83.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.291 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.512 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 52.1 ttt180 -60.21 -48.78 80.3 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.826 177.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.556 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -58.52 -30.43 67.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.889 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.545 ' HA ' HG22 ' A' ' 37' ' ' ILE . 55.9 tttt -66.05 -55.0 18.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.16 177.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -74.9 -10.87 59.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.099 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.512 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 60.3 mt-10 -88.3 -27.79 21.48 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.885 0.374 . . . . 0.0 110.395 172.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.556 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 1.3 tp-100 -86.42 -30.82 21.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.732 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -115.24 111.75 21.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.664 0.269 . . . . 0.0 110.818 -177.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.02 -39.35 91.99 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.974 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -53.38 -47.53 69.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.081 0.467 . . . . 0.0 110.93 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.439 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 22.3 mt -74.95 -31.16 61.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.439 -176.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.505 HH21 ' HA ' ' A' ' 106' ' ' GLU . 6.7 tpp180 -56.92 -50.45 72.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.529 176.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.99 -38.62 76.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.895 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 60.2 tp -60.3 -45.17 94.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 35.0 tp -62.08 -44.48 96.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.086 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.501 HD22 ' HB2' ' A' ' 156' ' ' LEU . 38.6 mt -74.72 -18.17 60.54 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.66 0.267 . . . . 0.0 111.21 -177.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.95 -23.22 52.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.446 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 57.9 p -71.88 -24.64 61.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.883 0.373 . . . . 0.0 110.931 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -47.84 136.47 10.62 Favored Pre-proline 0 C--O 1.234 0.25 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.891 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -100.78 33.3 8.6 Favored 'Cis proline' 0 CA--C 1.534 0.511 0 C-N-CA 124.26 -1.142 . . . . 0.0 113.641 -1.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.469 ' HB2' HG13 ' A' ' 11' ' ' VAL . . . -67.53 159.06 30.5 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -175.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.406 ' HB3' HG12 ' A' ' 16' ' ' ILE . 44.3 tttp -88.27 121.33 30.54 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.759 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.0 mt -90.09 114.34 26.24 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.787 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.607 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 61.6 t -129.61 114.96 32.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.625 -0.262 . . . . 0.0 111.118 -178.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -74.18 118.53 17.24 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.504 ' HA ' ' HB2' ' A' ' 135' ' ' ASP . 80.8 t60 -85.53 77.51 9.85 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.865 -0.734 . . . . 0.0 109.188 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.51 107.31 9.87 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.633 178.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -106.61 15.93 25.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.553 0.692 . . . . 0.0 110.404 -175.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -125.98 -25.04 3.65 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.371 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -131.86 136.78 47.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.49 176.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.488 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -99.9 85.81 3.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.34 0.591 . . . . 0.0 109.843 173.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.441 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 5.6 t80 178.07 140.32 0.09 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.006 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.734 ' HB3' HD22 ' A' ' 145' ' ' LEU . 12.2 m95 74.93 6.29 4.33 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.872 0.732 . . . . 0.0 112.089 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -172.3 -113.85 0.31 Allowed Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 118.572 -1.775 . . . . 0.0 114.369 -178.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.504 ' HB2' ' HA ' ' A' ' 126' ' ' HIS . 9.8 t70 -98.57 -49.42 4.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.068 -0.566 . . . . 0.0 112.007 -167.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . 0.488 ' HA2' ' HA ' ' A' ' 131' ' ' ALA . . . 82.6 -6.22 70.41 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.981 -177.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 94.2 16.95 41.86 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.586 -0.606 . . . . 0.0 111.586 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 20.4 p80 -168.6 24.91 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.501 -0.35 . . . . 0.0 111.005 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 79.08 -46.29 2.93 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.389 -0.434 . . . . 0.0 113.891 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -88.25 68.18 8.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.126 0.965 . . . . 0.0 110.67 -173.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -122.87 15.42 8.38 Favored Glycine 0 C--N 1.311 -0.82 0 CA-C-N 114.002 -1.454 . . . . 0.0 111.86 177.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.409 ' C ' ' H ' ' A' ' 144' ' ' ARG . 45.9 mttt 72.55 80.87 0.14 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.492 0.663 . . . . 0.0 111.36 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -67.49 4.79 0.93 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.741 -1.118 . . . . 0.0 111.774 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.711 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 12.3 ttp180 -58.22 -22.1 50.61 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.866 -0.521 . . . . 0.0 112.239 -175.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.734 HD22 ' HB3' ' A' ' 133' ' ' TRP . 41.8 tp -66.08 -48.47 70.86 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 174.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -64.46 -28.9 73.77 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 174.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . 0.488 ' HA ' ' HE2' ' A' ' 150' ' ' MET . 31.4 t80 -68.83 -37.31 79.08 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 175.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.711 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 79.7 mt -58.85 -47.61 84.27 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 172.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.412 HD23 HD12 ' A' ' 101' ' ' LEU . 96.0 mt -61.77 -38.5 88.23 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.866 178.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.488 ' HE2' ' HA ' ' A' ' 147' ' ' TYR . 72.4 mtm -72.11 -40.16 68.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.656 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -67.19 -38.66 85.75 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.121 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.527 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 61.3 tp -62.32 -46.21 89.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.687 174.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 2.8 ttp-105 -52.23 -44.99 65.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.644 175.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -67.44 -38.83 85.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.6 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -72.61 -35.62 67.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.903 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 76.5 mt -74.78 -23.54 58.53 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 176.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.4 -25.16 61.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.441 175.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.73 -39.75 82.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 175.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -63.34 -38.54 91.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.341 174.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -63.88 -41.1 97.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.23 176.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.4 -46.26 73.78 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.423 178.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 . . . . . 0 C--N 1.327 -0.376 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -176.311 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 37.6 t . . . . . 0 N--CA 1.453 -0.287 0 CA-C-O 121.297 0.57 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -107.42 29.8 6.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.314 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.85 76.75 1.15 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.142 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.577 178.795 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.4 m -70.99 151.38 9.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.966 0.413 . . . . 0.0 110.556 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.477 ' HG2' ' OG1' ' A' ' 15' ' ' THR . 0.0 OUTLIER -75.35 -66.66 0.74 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.234 -178.617 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' A' ' 12' ' ' MET . 58.3 tt0 174.51 -39.11 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.164 -0.925 . . . . 0.0 109.047 176.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -82.78 12.28 4.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.431 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.515 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 18.0 m -82.44 138.75 34.31 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.576 -174.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.625 HG12 ' HE3' ' A' ' 122' ' ' LYS . 61.2 mt -124.81 120.81 59.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.201 174.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.2 mp -89.98 101.22 12.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.633 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 18.7 m120 -91.77 101.06 13.66 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 176.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.405 ' HB2' ' CB ' ' A' ' 26' ' ' TYR . 37.1 p90 -107.38 174.82 5.72 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.344 -174.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.57 -179.26 5.58 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.266 -177.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.466 ' HA ' ' OG ' ' A' ' 30' ' ' SER . 17.2 m -64.51 -173.51 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.84 0.713 . . . . 0.0 112.356 -176.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.66 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 34.2 p -67.34 2.69 1.55 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -169.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.4 t -92.93 12.06 25.15 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.372 0.606 . . . . 0.0 109.801 176.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -129.22 166.63 19.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.172 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -61.55 -35.29 77.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.893 0.378 . . . . 0.0 110.668 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.405 ' CB ' ' HB2' ' A' ' 19' ' ' PHE . 98.8 m-85 -80.76 -1.42 42.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.954 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.66 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -57.03 -23.0 44.69 Favored Glycine 0 CA--C 1.52 0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 114.408 -174.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -69.44 -14.19 62.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 117.524 0.662 . . . . 0.0 111.27 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -73.44 -38.92 65.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.801 -0.181 . . . . 0.0 110.851 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.466 ' OG ' ' HA ' ' A' ' 21' ' ' SER . 64.6 m -59.27 158.84 8.51 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.674 0.749 . . . . 0.0 112.964 -173.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -69.96 -19.82 63.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.549 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.605 ' CE1' ' HB2' ' A' ' 71' ' ' PRO . 13.0 t80 -92.54 7.24 44.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.542 -176.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.52 129.0 37.3 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.593 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.502 ' HA ' HG21 ' A' ' 46' ' ' THR . . . -80.17 60.39 3.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.255 0.55 . . . . 0.0 111.387 -175.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 58.5 m95 -111.16 112.43 55.15 Favored Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.388 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.422 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 42.2 Cg_exo -57.13 126.91 23.65 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 123.183 2.589 . . . . 0.0 113.237 -175.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.498 ' CG1' ' HB2' ' A' ' 44' ' ' TRP . 37.6 pt -103.33 145.2 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.49 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.5 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 14.9 tptm -108.39 92.59 4.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.957 0.408 . . . . 0.0 109.901 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 26.1 t -121.33 128.25 75.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.136 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.7 t70 66.8 16.91 10.49 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.811 0.815 . . . . 0.0 110.255 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.9 10.97 83.34 Favored Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.703 -176.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 57.6 mttp -111.01 143.26 41.98 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 56.8 m -94.48 113.28 25.1 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.534 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.498 ' HB2' ' CG1' ' A' ' 37' ' ' ILE . 62.4 m95 -104.31 126.0 32.72 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 176.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 23.3 Cg_exo -62.91 -13.63 36.01 Favored 'Trans proline' 0 N--CA 1.473 0.281 0 C-N-CA 123.177 2.585 . . . . 0.0 113.059 -175.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.502 HG21 ' HA ' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -164.91 151.8 10.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.069 -178.256 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.9 m -58.53 -34.1 70.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.102 0.477 . . . . 0.0 109.954 175.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 51' ' ' PHE . 15.9 tm-20 -54.1 -42.97 69.98 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.311 177.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -69.54 -37.19 76.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.6 -175.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.468 ' CE2' HG12 ' A' ' 96' ' ' VAL . 90.8 t80 -69.91 -35.95 75.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 176.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.477 ' CZ ' ' HZ2' ' A' ' 89' ' ' TRP . 68.6 t80 -56.29 -52.51 64.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.761 177.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.624 ' NE2' ' HA ' ' A' ' 75' ' ' ALA . 17.1 mm-40 -66.81 -50.11 63.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.134 -178.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.513 ' HB3' ' HG3' ' A' ' 62' ' ' ARG . . . -58.51 -30.47 67.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.353 -177.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.477 ' HA ' HE21 ' A' ' 54' ' ' GLN . 0.0 OUTLIER -78.4 -42.92 28.82 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.154 178.216 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.521 ' HG2' HD23 ' A' ' 85' ' ' LEU . 27.3 ttpp -57.06 -39.65 75.32 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.158 -177.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -92.46 139.77 30.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.401 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.755 ' H ' HD22 ' A' ' 57' ' ' LEU . 1.5 pt? -113.45 18.4 17.73 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.371 0.605 . . . . 0.0 110.275 -178.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -96.11 128.25 42.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.631 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -60.75 -48.01 83.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.463 -177.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -59.12 -46.38 88.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.701 0.286 . . . . 0.0 111.498 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.525 ' CZ ' ' HE3' ' A' ' 83' ' ' LYS . 2.5 t80 -74.39 -32.59 62.78 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.01 -174.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.513 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 41.7 ttm180 -64.88 -35.32 80.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.226 0.536 . . . . 0.0 109.618 174.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.496 ' HG2' ' HD3' ' A' ' 67' ' ' ARG . 31.1 tt0 -70.24 -31.39 68.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.247 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -59.8 -48.85 80.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.042 0.449 . . . . 0.0 110.154 173.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.409 HG21 ' HB2' ' A' ' 52' ' ' GLN . 37.8 mm -62.14 -37.98 79.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.005 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -71.38 -23.81 61.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.019 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.496 ' HD3' ' HG2' ' A' ' 63' ' ' GLU . 25.5 mtp180 -99.78 13.68 32.87 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -173.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.7 m -118.69 132.41 68.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.073 0.463 . . . . 0.0 110.35 174.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.9 m -84.91 -30.72 24.14 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.084 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.416 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 39.6 m -81.19 122.2 81.2 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.036 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.605 ' HB2' ' CE1' ' A' ' 32' ' ' PHE . 10.8 Cg_exo -70.97 -33.31 12.2 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 123.073 2.515 . . . . 0.0 111.795 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.456 ' O ' ' HG3' ' A' ' 76' ' ' ARG . 52.3 ttm -60.82 -39.51 89.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.803 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.497 ' O ' ' HG3' ' A' ' 77' ' ' MET . 84.1 t -61.15 -52.0 66.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.327 177.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.509 ' HA ' ' HE2' ' A' ' 77' ' ' MET . . . -62.78 -40.7 98.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.025 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.624 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -60.32 -50.33 74.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.596 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 72' ' ' MET . 77.1 mtp180 -64.77 -47.78 76.93 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -175.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.509 ' HE2' ' HA ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -85.01 -8.29 58.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.979 0.419 . . . . 0.0 111.391 -177.696 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -93.87 -17.09 42.36 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.916 176.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -89.87 -1.15 57.92 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -175.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -82.37 131.23 35.23 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.018 174.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -106.13 22.68 15.29 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.626 0.727 . . . . 0.0 110.459 -170.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 59.8 m -70.87 -36.8 72.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.729 173.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.525 ' HE3' ' CZ ' ' A' ' 61' ' ' TYR . 16.1 pttm -86.53 158.12 54.74 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.797 175.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.422 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 60.7 Cg_endo -71.71 154.71 59.28 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.616 2.211 . . . . 0.0 113.473 -174.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.521 HD23 ' HG2' ' A' ' 55' ' ' LYS . 52.9 mt -121.57 171.95 8.45 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 175.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -70.79 141.18 51.4 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.7 -0.8 . . . . 0.0 109.37 174.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.472 ' HE3' ' HB2' ' A' ' 87' ' ' LYS . 35.1 ttmt -61.24 -46.66 89.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.168 -169.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -86.75 24.29 1.5 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.477 ' HZ2' ' CZ ' ' A' ' 51' ' ' PHE . 65.7 t-105 -59.06 -36.03 74.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.737 0.304 . . . . 0.0 111.56 -177.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.89 -30.46 67.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.839 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 28.8 m -94.8 -40.58 9.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.849 0.356 . . . . 0.0 111.075 -177.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.471 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.5 m -79.06 -8.08 11.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -176.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.446 ' O ' ' HG2' ' A' ' 97' ' ' MET . 62.3 tttp -52.83 -46.5 67.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.653 0.264 . . . . 0.0 111.155 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -77.63 -28.83 51.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.696 0.284 . . . . 0.0 111.061 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -68.88 -42.25 77.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.088 0.471 . . . . 0.0 109.988 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.468 HG12 ' CE2' ' A' ' 50' ' ' TYR . 75.4 t -61.35 -46.76 95.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.396 176.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.446 ' HG2' ' O ' ' A' ' 93' ' ' LYS . 83.2 mmm -61.04 -40.07 92.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.809 178.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 25.7 ttm-85 -62.26 -43.64 98.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.544 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -61.9 -44.46 96.75 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.884 0.373 . . . . 0.0 110.589 178.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.92 -44.21 93.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.121 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -69.53 -41.22 76.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.014 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -58.34 -53.67 55.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.539 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.97 -26.56 68.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.949 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.402 ' HA ' HG21 ' A' ' 37' ' ' ILE . 87.7 tttt -65.06 -55.31 19.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.64 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -79.3 -6.39 56.61 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.947 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.756 ' HA ' HH21 ' A' ' 112' ' ' ARG . 20.9 mt-10 -92.08 -35.45 13.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.598 0.237 . . . . 0.0 110.999 173.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.5 ' NE2' ' HB2' ' A' ' 38' ' ' LYS . 0.8 OUTLIER -66.41 -45.1 81.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.027 0.442 . . . . 0.0 110.364 179.23 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -113.81 111.41 21.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.114 -176.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.36 -22.14 66.25 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.61 178.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -57.12 -49.02 77.21 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.362 0.601 . . . . 0.0 109.873 175.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.8 mt -69.32 -38.39 78.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.231 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.756 HH21 ' HA ' ' A' ' 106' ' ' GLU . 42.5 ttm180 -58.42 -43.7 88.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.508 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.94 -43.03 99.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.836 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.7 tp -65.97 -40.15 91.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.537 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.649 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 44.0 tp -65.62 -35.39 80.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.985 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.1 mp -88.55 -3.77 58.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.881 0.372 . . . . 0.0 111.077 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.12 -34.73 24.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.048 0.452 . . . . 0.0 109.792 172.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 20.9 p -75.23 -14.96 60.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.936 176.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -59.3 138.23 88.65 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.275 176.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -104.99 39.66 3.47 Favored 'Cis proline' 0 N--CA 1.458 -0.6 0 C-N-CA 124.819 -0.909 . . . . 0.0 113.2 -2.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.515 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -75.48 176.28 7.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.94 0.4 . . . . 0.0 111.821 -176.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.625 ' HE3' HG12 ' A' ' 16' ' ' ILE . 51.6 mtmt -92.92 130.78 38.39 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.187 -179.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 59.8 mt -94.07 113.62 25.62 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.993 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.633 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 86.1 t -132.82 107.07 11.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.494 -175.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -77.34 117.82 19.2 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.424 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 7.4 t60 -85.71 113.32 21.81 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 3.6 t -136.95 112.49 9.34 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.382 0.611 . . . . 0.0 109.896 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.405 ' H ' ' HG3' ' A' ' 128' ' ' GLU . 0.0 OUTLIER -100.0 18.73 17.74 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.043 0.925 . . . . 0.0 108.548 171.327 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -95.53 -44.46 7.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.125 177.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -130.02 166.74 19.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.148 176.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.64 86.34 2.23 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.405 175.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -160.11 -35.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.124 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.659 ' HB3' HD23 ' A' ' 145' ' ' LEU . 71.5 m95 -120.79 20.71 11.63 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.485 -179.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -150.73 -150.31 5.26 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.43 -175.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.424 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 1.3 p-10 -82.43 -14.93 54.32 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 122.291 -0.534 . . . . 0.0 110.334 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . 0.548 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 68.0 26.42 73.99 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.886 176.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 76.81 -27.26 1.64 Allowed Glycine 0 CA--C 1.52 0.375 0 N-CA-C 114.31 0.484 . . . . 0.0 114.31 176.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . 0.458 ' NE2' ' HB3' ' A' ' 140' ' ' LYS . 20.7 p-80 -132.65 11.78 4.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.518 0.659 . . . . 0.0 111.801 -172.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 99.32 -27.09 21.72 Favored Glycine 0 CA--C 1.517 0.166 0 C-N-CA 120.552 -0.832 . . . . 0.0 113.048 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.458 ' HB3' ' NE2' ' A' ' 138' ' ' HIS . 65.6 tttp -107.4 69.97 0.77 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.587 0.708 . . . . 0.0 110.025 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.548 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -124.19 15.23 7.78 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.257 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 61.2 mttt 61.97 77.05 0.34 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.773 0.797 . . . . 0.0 110.929 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.419 ' OD1' HG11 ' A' ' 124' ' ' VAL . 8.8 t30 -77.9 5.58 9.39 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.75 -176.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.483 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 69.0 mtp85 -47.37 -22.22 0.4 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -178.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.659 HD23 ' HB3' ' A' ' 133' ' ' TRP . 49.2 tp -56.59 -47.54 79.37 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.272 0.558 . . . . 0.0 110.237 173.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.604 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -67.42 -27.96 73.59 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.792 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -68.93 -37.87 79.17 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 79.6 mt -61.26 -41.87 97.67 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.6 -34.33 78.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.837 177.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.604 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 67.4 mtt -61.48 -49.24 77.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.73 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -67.38 -37.15 82.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.71 0.29 . . . . 0.0 110.805 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 68.1 tp -63.67 -42.77 98.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.032 0.444 . . . . 0.0 110.065 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.649 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 1.1 ttp-105 -61.7 -42.55 99.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.954 177.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -57.52 -43.97 84.72 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.219 177.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -66.65 -45.5 78.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.255 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.489 HD11 HD23 ' A' ' 115' ' ' LEU . 90.9 mt -69.41 -28.16 65.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.828 0.347 . . . . 0.0 110.627 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.508 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -60.8 -45.46 94.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.186 175.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 69.8 mt -69.14 -34.07 61.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.72 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -56.39 -52.8 63.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.045 0.45 . . . . 0.0 109.79 177.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -76.44 -25.2 54.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.769 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 13.7 tp -70.11 -32.56 70.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.195 0.521 . . . . 0.0 110.005 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.444 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.189 177.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 C--O 1.236 0.342 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -82.68 84.79 7.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.667 0.746 . . . . 0.0 109.941 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.95 44.75 1.15 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.682 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 . . . . . 0 C--N 1.328 -0.349 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 173.857 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.8 m80 . . . . . 0 N--CA 1.465 0.301 0 CA-C-O 121.117 0.484 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.441 HG21 ' HB3' ' A' ' 121' ' ' ALA . 32.3 m -83.73 179.91 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.909 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 29.0 mtm -91.92 164.33 13.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.02 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -58.08 116.75 3.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.338 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 52.01 74.16 0.28 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.523 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.437 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 31.5 m -96.8 121.72 38.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.858 177.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 35.3 mm -81.33 95.78 2.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 176.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.9 mt -90.07 91.61 3.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.443 0.639 . . . . 0.0 109.794 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.603 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.3 p30 -96.49 101.96 13.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.421 178.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -102.81 132.08 49.24 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.519 -172.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -150.2 100.47 2.9 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.566 173.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.518 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 18.4 t 176.29 61.7 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -177.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.2 m -74.53 2.72 9.01 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.32 -171.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.36 -79.0 0.02 OUTLIER 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -175.37 81.65 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -170.55 -110.43 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.883 -172.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -101.26 -15.69 17.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.2 0.524 . . . . 0.0 110.243 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.518 ' HA3' ' O ' ' A' ' 21' ' ' SER . . . -74.08 -0.45 56.45 Favored Glycine 0 CA--C 1.52 0.364 0 CA-C-N 115.863 -0.608 . . . . 0.0 113.303 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.36 -1.56 3.57 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.023 0.44 . . . . 0.0 112.004 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -65.17 -32.31 73.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.578 169.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.9 m -62.99 156.71 23.82 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.437 0.637 . . . . 0.0 112.046 -174.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.599 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 5.5 p-10 -70.66 -24.93 62.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.906 178.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -76.6 -2.26 31.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.715 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.425 ' O ' HG21 ' A' ' 46' ' ' THR . . . -64.72 136.1 56.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.945 -177.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.79 57.83 2.66 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.456 -172.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 66.2 m95 -116.63 105.5 49.88 Favored Pre-proline 0 C--N 1.316 -0.86 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.607 177.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.27 138.18 78.86 Favored 'Trans proline' 0 C--O 1.238 0.482 0 C-N-CA 123.324 2.683 . . . . 0.0 113.029 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.401 HG13 ' HB2' ' A' ' 44' ' ' TRP . 16.2 pt -123.81 137.65 56.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.363 -178.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -98.66 107.67 20.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.423 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.0 t -123.72 113.27 36.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -174.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 55.27 36.72 27.65 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.437 172.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.08 -1.18 62.74 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.502 173.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -129.34 144.7 51.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 117.635 0.718 . . . . 0.0 110.42 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.0 m -98.53 122.74 42.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.861 -175.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.454 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 41.5 m95 -112.16 134.55 21.44 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.642 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 37.9 Cg_exo -60.79 -41.63 44.56 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.833 2.355 . . . . 0.0 112.554 -177.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.425 HG21 ' O ' ' A' ' 33' ' ' ALA . 21.0 p -144.77 178.63 7.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.698 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.599 ' HB2' ' HB2' ' A' ' 31' ' ' ASN . 21.5 m -74.02 -44.1 55.62 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -173.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.466 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 1.9 pm0 -76.93 -10.31 59.28 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.502 -173.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.516 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 11.2 m80 -71.74 -38.01 70.49 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 172.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -71.46 -35.81 70.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.466 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 83.0 t80 -59.89 -56.42 21.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.549 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.503 ' NE2' ' HA3' ' A' ' 78' ' ' GLY . 5.1 mm100 -66.28 -21.7 66.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.211 -0.45 . . . . 0.0 112.016 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.441 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -76.32 -48.99 18.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.004 0.43 . . . . 0.0 110.455 176.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.47 -14.48 62.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.136 0.493 . . . . 0.0 110.338 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -60.64 -34.45 74.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.769 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.502 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 96.8 m-85 -109.17 157.7 18.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.383 -178.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.14 32.7 5.33 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.265 0.555 . . . . 0.0 111.1 -177.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.503 ' OD2' ' HB2' ' A' ' 60' ' ' LYS . 8.6 t70 -136.0 118.34 15.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.518 178.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.535 ' HA ' ' HB2' ' A' ' 62' ' ' ARG . 21.4 mm-40 -65.97 -14.07 60.93 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -177.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.503 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . 58.4 mttp -72.71 -55.11 7.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.96 0.409 . . . . 0.0 109.956 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.404 ' O ' HG12 ' A' ' 65' ' ' ILE . 55.2 t80 -71.6 -26.0 62.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.933 0.397 . . . . 0.0 110.321 177.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.535 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . 12.5 mtp180 -71.44 -27.34 63.21 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.805 0.336 . . . . 0.0 110.507 175.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.3 tt0 -69.91 -32.38 70.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 170.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.02 -40.75 95.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.591 175.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.425 HD11 ' HE1' ' A' ' 77' ' ' MET . 40.5 mm -65.16 -29.79 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.693 0.758 . . . . 0.0 110.29 175.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -74.58 -29.54 61.37 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.267 174.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -81.01 -28.47 35.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.207 -177.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.452 ' O ' HG12 ' A' ' 68' ' ' VAL . 10.3 p -70.83 101.37 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.722 0.772 . . . . 0.0 110.139 177.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.9 m -76.05 -26.17 56.32 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.966 -177.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.458 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.1 m -78.97 133.47 61.46 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.395 178.253 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.516 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 28.0 Cg_exo -62.12 -65.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.359 2.706 . . . . 0.0 113.986 -175.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 27.8 ttt -68.95 -26.45 65.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.776 0.322 . . . . 0.0 111.5 -172.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 86.3 t -62.82 -28.88 45.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.041 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.77 -47.49 84.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.031 0.443 . . . . 0.0 110.707 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.99 -30.52 62.52 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.95 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.412 ' HE ' ' C ' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -63.11 -49.12 75.65 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.574 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.425 ' HE1' HD11 ' A' ' 65' ' ' ILE . 25.2 ptt? -77.54 -24.67 49.87 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 176.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.503 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -76.78 -2.14 75.17 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.274 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 76' ' ' ARG . 21.3 mmt180 -67.18 -18.77 65.41 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 122.31 0.244 . . . . 0.0 110.883 170.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.509 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 20.5 t70 -69.07 134.12 48.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.024 0.44 . . . . 0.0 110.402 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' A' ' 81' ' ' ARG . 24.6 ttp-105 -118.18 17.87 13.89 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.278 -175.282 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 88.2 p -98.13 0.39 45.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.503 0.668 . . . . 0.0 109.593 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.509 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 41.1 mmtm -95.75 153.26 39.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 174.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.69 103.85 1.71 Allowed 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 121.44 1.426 . . . . 0.0 112.075 -178.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.403 HD22 ' HG3' ' A' ' 81' ' ' ARG . 2.4 pp -109.68 169.85 8.44 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.165 176.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 -86.07 133.23 33.9 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.04 -176.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -70.6 -33.39 71.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.842 0.353 . . . . 0.0 111.0 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -85.4 9.98 14.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.096 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.456 ' HA ' HG22 ' A' ' 92' ' ' VAL . 67.8 t-105 -54.5 -30.44 53.43 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.969 0.414 . . . . 0.0 110.203 175.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -53.66 -32.23 50.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.618 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.2 m -99.82 -45.46 5.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.698 0.285 . . . . 0.0 111.498 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.456 HG22 ' HA ' ' A' ' 89' ' ' TRP . 31.9 m -74.94 -11.22 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -171.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.4 pttm -63.27 -29.59 70.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.771 0.32 . . . . 0.0 110.647 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.483 ' OE1' ' HD3' ' A' ' 144' ' ' ARG . 9.5 mm-40 -68.16 -39.89 82.47 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.644 0.735 . . . . 0.0 109.49 177.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.87 -41.66 67.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.882 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 92' ' ' VAL . 79.7 t -63.8 -39.55 85.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.065 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.8 mmt -62.49 -46.14 89.81 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.576 176.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.718 HH21 HD23 ' A' ' 148' ' ' LEU . 26.1 ttm180 -63.75 -32.57 74.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.35 . . . . 0.0 110.545 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -63.93 -50.33 69.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.365 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.36 87.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.976 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.6 -35.52 80.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.098 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -58.88 -53.83 53.97 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.95 -37.51 82.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.739 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -52.61 -54.02 38.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.357 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -86.5 -8.38 57.62 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.684 ' HA ' HH21 ' A' ' 112' ' ' ARG . 24.9 mt-10 -92.61 -33.01 14.58 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 121.868 -0.52 . . . . 0.0 111.518 175.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -79.17 -30.87 43.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.674 0.273 . . . . 0.0 110.761 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -115.28 103.38 10.76 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.778 0.323 . . . . 0.0 110.997 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.439 ' HA ' ' HB3' ' A' ' 112' ' ' ARG . . . -65.26 -24.42 67.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.513 178.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . 0.435 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 2.0 mp0 -51.4 -56.08 15.13 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.455 172.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.9 mt -74.2 -31.65 62.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.333 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.684 HH21 ' HA ' ' A' ' 106' ' ' GLU . 13.7 tpp85 -50.48 -60.62 2.82 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.316 177.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.16 -34.35 70.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.025 -176.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.91 -40.22 94.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.434 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 29.3 tp -67.64 -49.56 62.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.278 178.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.492 HD21 ' HG3' ' A' ' 153' ' ' ARG . 53.0 mt -63.56 -24.89 68.0 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -173.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -74.47 -7.22 52.28 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 72.0 p -86.8 -15.4 39.38 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.363 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.425 ' HA ' HH21 ' A' ' 153' ' ' ARG . . . -54.87 141.86 56.74 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.394 177.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . 0.524 ' HA ' HH21 ' A' ' 153' ' ' ARG . 43.9 Cg_endo -101.22 41.94 3.45 Favored 'Cis proline' 0 CA--C 1.535 0.572 0 C-N-CA 124.5 -1.042 . . . . 0.0 113.134 -1.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.441 ' HB3' HG21 ' A' ' 11' ' ' VAL . . . -72.92 166.93 22.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.94 0.4 . . . . 0.0 111.704 -178.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 39.3 tttp -100.98 119.35 38.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.589 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 24.2 mt -88.7 125.35 34.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.433 -175.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.603 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 42.2 t -134.36 134.11 54.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.432 -175.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.504 ' HB3' ' HA3' ' A' ' 134' ' ' GLY . 0.0 OUTLIER -81.02 137.66 36.04 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.31 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 18' ' ' ASN . 23.7 t-160 -130.77 79.94 1.92 Allowed 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.55 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.5 t -87.55 166.22 14.9 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 164.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -140.16 67.75 1.37 Allowed 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.833 0.825 . . . . 0.0 110.454 -176.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -162.69 -44.85 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.866 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . 0.493 ' O ' ' HA2' ' A' ' 136' ' ' GLY . 2.6 m-20 -125.9 -179.9 4.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -124.17 86.19 2.53 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 170.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -97.35 -49.55 4.88 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -167.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.621 ' HB3' ' HB2' ' A' ' 145' ' ' LEU . 78.9 m95 -140.06 25.18 2.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.457 0.646 . . . . 0.0 110.588 178.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.513 ' HA2' ' HA ' ' A' ' 143' ' ' ASN . . . -163.07 -84.22 0.05 OUTLIER Glycine 0 N--CA 1.439 -1.163 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.575 -177.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -160.1 164.28 33.17 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.502 -178.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . 0.493 ' HA2' ' O ' ' A' ' 130' ' ' ASP . . . -98.38 24.12 33.32 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 175.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 74.24 37.27 48.76 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 115.071 -0.565 . . . . 0.0 113.748 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -144.58 -27.0 0.5 Allowed 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' A' ' 140' ' ' LYS . . . 99.71 56.44 0.96 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.282 -0.485 . . . . 0.0 113.218 174.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 139' ' ' GLY . 13.0 ttpp 169.86 69.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 123.675 0.79 . . . . 0.0 109.126 176.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -132.35 -65.11 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 119.333 -1.413 . . . . 0.0 114.363 -175.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.414 ' C ' ' H ' ' A' ' 144' ' ' ARG . 39.6 tttm -178.51 52.08 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.499 0.65 . . . . 0.0 111.088 -171.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.513 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 3.4 t-20 -69.28 5.29 1.32 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.076 0.95 . . . . 0.0 111.708 -177.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.69 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 1.6 ttt180 -57.58 -21.43 38.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.621 ' HB2' ' HB3' ' A' ' 133' ' ' TRP . 23.6 tp -65.53 -44.45 86.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.357 175.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -66.35 -32.14 81.06 Favored Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.177 175.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . 0.424 ' HA ' ' HE2' ' A' ' 150' ' ' MET . 60.7 t80 -61.85 -40.57 95.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.017 0.437 . . . . 0.0 110.032 175.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.718 HD23 HH21 ' A' ' 98' ' ' ARG . 46.4 mt -63.73 -45.5 89.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.767 174.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.4 mt -61.02 -46.24 91.53 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.33 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.424 ' HE2' ' HA ' ' A' ' 147' ' ' TYR . 58.1 mtm -64.84 -43.4 93.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.907 -176.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . 0.441 ' O ' ' HG2' ' A' ' 155' ' ' GLN . 33.4 mt-10 -63.73 -44.97 91.96 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.64 176.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.44 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 58.7 tp -58.82 -45.21 90.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.182 0.515 . . . . 0.0 110.161 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.821 ' HB3' HH11 ' A' ' 153' ' ' ARG . 1.2 ttp-105 -57.82 -43.48 85.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.873 177.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.7 -40.79 97.66 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.802 177.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.856 HE21 ' HA ' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -65.87 -41.45 91.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.749 179.437 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.469 ' HB2' HD23 ' A' ' 116' ' ' LEU . 97.2 mt -66.13 -36.36 82.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.859 0.361 . . . . 0.0 110.267 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -63.72 -42.48 97.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.858 177.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 77.5 mt -70.22 -43.79 78.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.704 0.288 . . . . 0.0 111.046 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -62.71 -29.12 70.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.293 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -87.28 -29.66 21.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.433 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 15.9 tp -62.05 -35.49 78.79 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.879 -177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 115.782 -0.644 . . . . 0.0 112.175 -176.307 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.457 ' O ' ' HB2' ' A' ' 25' ' ' ASP . 12.5 p . . . . . 0 C--O 1.225 -0.187 0 CA-C-O 120.378 0.133 . . . . 0.0 111.355 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 4' ' ' ARG . 14.7 mtp180 66.27 -79.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.303 -175.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.592 ' HB2' HD23 ' A' ' 114' ' ' LEU . . . 73.01 -40.29 0.47 Allowed 'General case' 0 N--CA 1.469 0.497 0 O-C-N 124.004 0.815 . . . . 0.0 112.062 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 . . . . . 0 C--N 1.325 -0.458 0 CA-C-O 120.905 0.383 . . . . 0.0 111.773 -178.856 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.2 t60 . . . . . 0 N--CA 1.465 0.305 0 CA-C-O 121.271 0.557 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -83.91 168.0 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.269 177.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.504 ' HE2' ' HB ' ' A' ' 15' ' ' THR . 0.0 OUTLIER -80.73 -84.55 0.1 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.965 -179.156 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.5 ' H ' ' HG2' ' A' ' 12' ' ' MET . 81.9 mm-40 -133.61 -72.17 0.5 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -175.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -137.16 86.8 2.23 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.712 -171.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.504 ' HB ' ' HE2' ' A' ' 12' ' ' MET . 3.3 t -117.94 149.93 40.08 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.34 178.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.494 HD13 ' HB2' ' A' ' 122' ' ' LYS . 32.1 mm -94.68 113.18 28.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.924 177.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.0 mt -96.05 101.89 12.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 120.924 0.392 . . . . 0.0 110.301 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 22.9 m-80 -84.86 104.21 14.61 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.014 177.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -109.92 130.61 55.51 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.92 0.391 . . . . 0.0 110.467 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -150.54 137.82 19.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.968 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.1 m 73.18 130.41 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 O-C-N 124.144 0.902 . . . . 0.0 111.444 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.492 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 20.6 p -56.38 -30.7 63.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.827 -178.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.7 m 62.82 -85.94 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.691 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -160.41 -40.97 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.457 ' HB2' ' O ' ' A' ' 3' ' ' VAL . 4.3 p-10 -137.54 -52.7 0.65 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 120.154 -0.618 . . . . 0.0 112.595 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -77.68 -9.77 59.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.115 0.483 . . . . 0.0 111.59 -174.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.492 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -76.7 -0.52 68.55 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 116.187 -0.461 . . . . 0.0 113.279 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.416 ' CG ' ' HZ1' ' A' ' 104' ' ' LYS . 26.6 t70 -53.07 -25.89 14.28 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -178.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -62.78 -18.91 63.42 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.9 m -78.84 136.73 37.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.978 0.418 . . . . 0.0 109.943 175.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -65.48 -15.65 62.87 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.837 -174.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -88.79 20.97 3.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.982 0.42 . . . . 0.0 110.955 -176.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.64 175.42 2.92 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.953 171.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -134.9 81.7 1.91 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.892 0.377 . . . . 0.0 111.681 -176.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.461 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 92.9 m95 -121.1 137.23 26.41 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.465 177.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 7.4 Cg_exo -72.03 112.08 3.33 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.748 2.299 . . . . 0.0 111.544 177.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.488 HG13 ' HB2' ' A' ' 44' ' ' TRP . 17.4 pt -107.27 117.21 52.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.319 0.58 . . . . 0.0 110.649 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -81.58 95.69 7.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.862 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.427 ' HB ' ' CD1' ' A' ' 44' ' ' TRP . 24.7 t -118.61 125.18 74.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.288 -177.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.6 t70 62.48 28.49 16.8 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.714 0.769 . . . . 0.0 110.07 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.32 7.34 87.78 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.375 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -117.67 137.23 52.8 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.648 0.261 . . . . 0.0 110.386 -176.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.1 m -87.72 98.03 11.22 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.434 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.488 ' HB2' HG13 ' A' ' 37' ' ' ILE . 66.9 m95 -90.41 126.19 57.3 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 11.2 Cg_exo -72.15 61.16 3.24 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.852 2.368 . . . . 0.0 112.418 178.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 93.2 165.15 0.03 OUTLIER 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.338 1.055 . . . . 0.0 111.323 172.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.4 p -52.41 -43.91 65.07 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.34 -173.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -43.56 -45.28 6.56 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 123.553 0.533 . . . . 0.0 112.205 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -74.34 -46.17 42.45 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.141 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -60.72 -35.57 76.66 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.152 0.501 . . . . 0.0 110.522 175.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.479 ' CZ ' ' HZ2' ' A' ' 89' ' ' TRP . 81.4 t80 -59.95 -57.45 12.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.239 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -67.3 -34.0 76.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.324 -176.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.95 -30.65 71.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.902 0.382 . . . . 0.0 111.081 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.587 ' HG2' HG22 ' A' ' 96' ' ' VAL . 4.5 tp-100 -85.95 -26.89 25.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.114 0.483 . . . . 0.0 109.893 178.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -67.84 -47.87 67.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.385 -178.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -90.47 143.17 27.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.05 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.597 ' H ' HD23 ' A' ' 57' ' ' LEU . 2.2 pt? -102.66 3.13 36.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.0 110.328 176.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.32 122.87 22.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.639 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -63.58 -51.01 67.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.655 -173.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 63' ' ' GLU . 24.9 ttpp -68.44 -34.21 75.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.817 0.341 . . . . 0.0 110.359 -177.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.651 ' O ' HG12 ' A' ' 65' ' ' ILE . 2.0 t80 -68.34 -34.53 76.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.316 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -62.1 -35.72 79.54 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.989 0.423 . . . . 0.0 110.193 174.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.463 ' HB3' ' O ' ' A' ' 60' ' ' LYS . 10.1 tp10 -61.2 -45.65 93.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.696 174.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.504 ' HA ' ' HB2' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -62.04 -35.16 77.76 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.547 176.693 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.651 HG12 ' O ' ' A' ' 61' ' ' TYR . 48.9 mm -62.51 -40.35 87.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.795 0.331 . . . . 0.0 110.766 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -90.03 -0.41 57.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.173 0.511 . . . . 0.0 110.456 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.504 ' HB2' ' HA ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -83.03 -30.31 28.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.328 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.1 m -90.96 133.46 32.62 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.136 -176.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.3 m -81.72 -38.95 24.96 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.641 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.4 ' HB2' HG22 ' A' ' 73' ' ' VAL . 17.0 m -77.9 124.77 86.18 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.266 -177.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -65.5 -27.86 53.93 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.72 2.28 . . . . 0.0 111.724 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 79.6 mtp -60.2 -39.24 85.87 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.887 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.567 ' O ' ' HG2' ' A' ' 77' ' ' MET . 46.0 t -66.53 -43.62 90.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.02 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.23 -47.37 85.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.941 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.534 ' O ' ' HG3' ' A' ' 79' ' ' ARG . . . -61.1 -47.8 84.63 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.891 0.377 . . . . 0.0 111.039 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -58.25 -49.56 76.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.86 -177.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.567 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 26.0 ptt? -81.66 -11.53 59.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.79 0.329 . . . . 0.0 110.94 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -81.26 -16.51 73.97 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.013 -0.613 . . . . 0.0 111.892 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 75' ' ' ALA . 92.9 mtt180 -79.74 -10.32 59.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.554 0.216 . . . . 0.0 110.963 175.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.472 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 22.3 t70 -72.09 140.22 48.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.673 -176.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 87.7 mtm-85 -122.95 20.27 10.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.873 0.368 . . . . 0.0 111.274 -177.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.8 p -98.17 5.69 48.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.556 0.693 . . . . 0.0 109.187 172.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.472 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 43.6 mmtm -102.69 159.28 29.81 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.255 175.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.84 108.08 0.85 Allowed 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.262 1.974 . . . . 0.0 112.498 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 89.0 mt -98.63 151.45 20.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.216 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.611 HH21 ' ND2' ' A' ' 88' ' ' ASN . 16.4 ptm180 -96.88 140.52 31.31 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.353 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.62 ' HA ' ' HE2' ' A' ' 87' ' ' LYS . 0.6 OUTLIER -78.07 -28.3 48.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.146 0.498 . . . . 0.0 109.944 -178.289 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.611 ' ND2' HH21 ' A' ' 86' ' ' ARG . 22.9 p-10 -83.26 15.86 2.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.853 178.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.479 ' HZ2' ' CZ ' ' A' ' 51' ' ' PHE . 38.0 t-105 -62.41 -37.39 85.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.111 175.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.8 -31.6 72.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.939 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.3 m -71.59 -46.63 58.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.199 -178.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.498 ' O ' HG21 ' A' ' 96' ' ' VAL . 34.8 m -92.37 -1.31 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.549 -175.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.579 ' HG2' ' HZ2' ' A' ' 133' ' ' TRP . 80.8 tttt -48.57 -53.2 19.27 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 123.383 0.673 . . . . 0.0 111.292 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -66.83 -40.58 88.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.855 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -62.15 -49.74 74.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.953 -177.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.587 HG22 ' HG2' ' A' ' 54' ' ' GLN . 77.5 t -58.08 -48.98 82.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.895 -178.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 4.4 mmt -59.6 -53.77 54.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.677 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.438 ' HD3' HD23 ' A' ' 148' ' ' LEU . 38.8 ttp85 -69.94 -29.71 66.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.456 -174.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -70.49 -42.29 71.56 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.62 0.248 . . . . 0.0 110.512 178.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.71 -43.98 87.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.094 0.473 . . . . 0.0 110.283 178.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.458 HD12 HD23 ' A' ' 149' ' ' LEU . 76.6 mt -62.38 -42.64 99.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.756 176.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.517 ' HA ' HD23 ' A' ' 152' ' ' LEU . 41.4 ttm180 -56.27 -50.17 72.11 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.159 176.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.81 -37.09 70.7 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 123.487 0.492 . . . . 0.0 111.902 -177.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.416 ' HZ1' ' CG ' ' A' ' 28' ' ' ASP . 29.8 ttpt -68.11 -55.6 11.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.636 0.255 . . . . 0.0 110.816 -178.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 84.2 m-85 -70.14 -29.69 66.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.917 0.389 . . . . 0.0 111.245 -177.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -67.48 -44.35 78.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.087 0.47 . . . . 0.0 110.595 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -84.68 -31.3 24.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.967 -172.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -108.74 110.83 22.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.263 0.554 . . . . 0.0 111.019 177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.48 -26.43 66.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.531 -177.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -58.94 -49.43 77.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.456 0.646 . . . . 0.0 109.837 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.05 -36.23 66.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.337 -175.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 1.6 ttp180 -65.34 -39.16 92.03 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.506 177.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.58 -45.07 95.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.979 175.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.592 HD23 ' HB2' ' A' ' 5' ' ' ALA . 61.5 tp -60.78 -47.14 87.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.611 177.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.537 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 53.2 tp -59.31 -50.51 73.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.184 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.49 HD13 ' HG3' ' A' ' 112' ' ' ARG . 9.5 mp -73.55 -11.31 60.4 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.05 -21.19 33.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.589 0.233 . . . . 0.0 111.194 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 77.6 p -82.66 -21.56 34.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.932 0.396 . . . . 0.0 110.861 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.504 ' HB1' ' HD2' ' A' ' 153' ' ' ARG . . . -59.71 141.48 88.82 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.185 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -100.08 41.33 3.83 Favored 'Cis proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.222 -1.158 . . . . 0.0 113.676 1.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.51 165.3 24.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.827 0.346 . . . . 0.0 110.644 177.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.494 ' HB2' HD13 ' A' ' 16' ' ' ILE . 65.8 mttt -94.8 125.34 39.39 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.251 0.548 . . . . 0.0 111.343 -177.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 62.5 mt -86.64 101.35 13.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.185 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 87.0 t -116.1 106.55 20.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.351 -179.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -75.68 119.66 20.0 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 175.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -88.78 77.49 7.83 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.634 0.731 . . . . 0.0 109.153 -176.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.432 ' HB ' ' HA3' ' A' ' 134' ' ' GLY . 22.5 m -96.82 105.64 17.8 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.295 176.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -98.89 -9.23 24.47 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.727 -172.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.447 ' O ' ' HB2' ' A' ' 130' ' ' ASP . 28.2 t-20 -96.52 96.55 8.75 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' A' ' 129' ' ' ASN . 5.6 m-20 69.69 154.44 0.12 Allowed 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.985 0.803 . . . . 0.0 111.214 -172.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB2' ' HA3' ' A' ' 141' ' ' GLY . . . -99.54 85.6 3.18 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.35 0.595 . . . . 0.0 109.478 173.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.53 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 63.6 t80 -134.97 102.29 5.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.145 -178.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.735 ' HB3' HD22 ' A' ' 145' ' ' LEU . 78.5 m95 63.53 17.6 10.48 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.845 0.716 . . . . 0.0 110.209 -172.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.432 ' HA3' ' HB ' ' A' ' 127' ' ' THR . . . -148.46 155.76 26.56 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.509 ' CG ' ' HB2' ' A' ' 143' ' ' ASN . 2.9 m-20 -88.68 34.44 0.77 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -170.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 59.18 21.33 53.14 Favored Glycine 0 C--O 1.228 -0.28 0 C-N-CA 121.187 -0.53 . . . . 0.0 112.523 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 79.08 -53.11 4.11 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.68 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -67.91 -31.41 71.16 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.646 0.609 . . . . 0.0 112.646 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 119.83 42.15 0.54 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.996 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.5 tttt -172.77 87.32 0.07 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 174.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.41 ' HA3' ' HB2' ' A' ' 131' ' ' ALA . . . -152.74 -64.75 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 119.586 -1.292 . . . . 0.0 113.398 173.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.53 ' HD2' ' HA ' ' A' ' 132' ' ' TYR . 58.0 mttp -164.14 43.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.879 0.34 . . . . 0.0 111.029 -174.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.509 ' HB2' ' CG ' ' A' ' 135' ' ' ASP . 4.0 t-20 -61.1 4.95 0.07 Allowed 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 177.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.546 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 32.2 mtp180 -58.39 -24.13 59.11 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 122.167 -0.333 . . . . 0.0 110.916 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.735 HD22 ' HB3' ' A' ' 133' ' ' TRP . 47.5 tp -61.95 -50.67 71.19 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.006 0.431 . . . . 0.0 110.046 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.626 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -64.75 -32.82 85.47 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.545 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -65.44 -40.92 93.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.807 0.337 . . . . 0.0 110.437 176.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.0 mt -62.12 -38.7 89.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.004 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.458 HD23 HD12 ' A' ' 101' ' ' LEU . 77.8 mt -63.31 -36.93 85.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.82 176.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.626 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 60.8 mtt -61.73 -51.94 66.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.0 0.428 . . . . 0.0 110.128 177.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -63.37 -43.07 98.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.279 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.517 HD23 ' HA ' ' A' ' 102' ' ' ARG . 65.6 tp -61.37 -46.43 90.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.992 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.537 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 29.4 ttp85 -59.16 -39.45 82.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.713 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -65.3 -42.78 92.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.123 0.487 . . . . 0.0 110.106 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -63.59 -39.77 95.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.282 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.474 HD11 ' HD3' ' A' ' 112' ' ' ARG . 67.2 mt -78.9 -12.8 60.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.981 0.419 . . . . 0.0 110.516 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.468 ' HA ' HD21 ' A' ' 116' ' ' LEU . . . -78.66 -33.82 46.79 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.8 173.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.426 ' O ' ' HG3' ' A' ' 162' ' ' GLU . 1.4 mp -56.9 -38.28 58.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.835 177.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -63.42 -34.79 78.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.892 0.377 . . . . 0.0 110.46 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -72.79 -25.27 61.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.695 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.52 -23.72 61.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.878 0.37 . . . . 0.0 110.395 175.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 158' ' ' ILE . 46.0 mt-10 . . . . . 0 C--N 1.331 -0.223 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.376 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.4 t . . . . . 0 N--CA 1.465 0.298 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 61.8 mtm-85 -81.6 48.75 1.22 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.573 0.701 . . . . 0.0 110.977 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.442 ' HB2' HD12 ' A' ' 114' ' ' LEU . . . -85.63 -174.29 5.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.483 174.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 . . . . . 0 N--CA 1.463 0.194 0 O-C-N 123.13 0.269 . . . . 0.0 110.883 -179.141 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.8 m -84.98 -178.06 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.06 0.457 . . . . 0.0 110.799 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.4 mtm -100.28 165.83 11.28 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.844 -178.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.99 112.18 3.71 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 175.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 64.84 83.06 0.17 Allowed 'General case' 0 C--N 1.331 -0.231 0 O-C-N 123.943 0.777 . . . . 0.0 110.598 -174.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.486 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 31.7 m -115.12 120.49 39.95 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.398 177.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 31.6 mt -96.98 107.16 19.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.325 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.6 mt -101.64 101.14 11.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.706 -175.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.524 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 38.0 m-80 -87.3 105.02 16.95 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.529 175.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -110.77 166.77 10.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.33 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -150.12 122.9 8.66 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.538 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 81.2 p 56.57 -176.57 0.05 Allowed 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.0 0.92 . . . . 0.0 111.941 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.526 HG23 ' HA ' ' A' ' 28' ' ' ASP . 40.6 p -80.86 -27.84 36.25 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -172.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.425 ' HG ' ' C ' ' A' ' 22' ' ' THR . 61.5 p 50.98 -90.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.787 0.835 . . . . 0.0 112.045 -177.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -107.56 -93.3 0.4 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -131.95 0.48 3.87 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.018 0.437 . . . . 0.0 110.77 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -101.26 -13.85 17.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.103 0.478 . . . . 0.0 110.986 -176.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.483 ' C ' ' HA ' ' A' ' 22' ' ' THR . . . -94.08 0.24 66.46 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.126 -175.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.526 ' HA ' HG23 ' A' ' 22' ' ' THR . 36.3 m-20 -62.11 0.95 0.35 Allowed 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -174.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -62.3 -31.22 71.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.759 0.314 . . . . 0.0 110.25 171.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 74.7 m -58.48 153.15 16.52 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.511 0.672 . . . . 0.0 112.335 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -76.85 -16.45 59.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.716 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -86.42 6.28 30.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.031 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.0 146.17 39.17 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.844 177.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.513 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -91.21 21.1 4.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.683 -173.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.446 ' HE1' ' CG ' ' A' ' 28' ' ' ASP . 77.4 m95 -89.85 124.85 62.67 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-O 120.713 0.292 . . . . 0.0 110.959 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.416 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 36.6 Cg_endo -66.71 128.59 19.26 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.554 2.169 . . . . 0.0 111.931 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.618 HG21 ' HA ' ' A' ' 104' ' ' LYS . 16.0 pt -103.12 137.75 30.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.915 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.43 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 43.4 tptt -100.2 101.18 12.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.057 -178.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.423 ' O ' ' HB3' ' A' ' 40' ' ' ASP . 42.1 t -115.63 125.03 72.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.469 -178.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.423 ' HB3' ' O ' ' A' ' 39' ' ' VAL . 20.6 t70 74.96 -62.67 0.45 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.363 1.078 . . . . 0.0 110.174 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.31 28.69 0.04 OUTLIER Glycine 0 C--N 1.298 -1.53 0 CA-C-N 113.3 -1.773 . . . . 0.0 109.928 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.1 mttp -135.39 142.01 45.6 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -172.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.9 m -102.09 106.42 17.3 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.764 -175.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.478 ' HB2' HG13 ' A' ' 37' ' ' ILE . 49.4 m95 -93.25 122.34 63.4 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.587 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 44' ' ' TRP . 4.4 Cg_endo -48.26 -36.31 29.24 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.698 2.932 . . . . 0.0 114.007 -175.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.513 HG22 ' HA ' ' A' ' 34' ' ' ALA . 55.2 p -148.3 166.22 28.68 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.9 t -63.41 -39.88 95.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.589 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.645 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 5.0 mm-40 -57.64 -37.64 73.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.834 178.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.402 ' CG ' ' HG2' ' A' ' 45' ' ' PRO . 25.7 m80 -60.93 -43.87 98.02 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.551 0.215 . . . . 0.0 111.332 -178.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -68.49 -38.83 81.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.887 0.375 . . . . 0.0 110.683 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -62.71 -45.76 91.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.616 -179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.645 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 53.0 mm-40 -70.06 -33.91 72.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.749 -178.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.34 -44.61 82.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.426 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -81.62 -12.04 58.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.309 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.577 ' HE3' ' HA ' ' A' ' 79' ' ' ARG . 51.1 tttm -65.95 -28.34 68.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.708 175.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.613 ' CE1' ' HB2' ' A' ' 83' ' ' LYS . 96.3 m-85 -110.71 166.5 10.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.182 0.515 . . . . 0.0 111.185 -178.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.569 ' H ' HD22 ' A' ' 57' ' ' LEU . 2.2 pt? -123.25 2.71 9.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.438 175.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -76.27 138.59 40.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.649 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -62.92 -56.15 19.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.562 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -58.84 -47.56 84.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.986 -173.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.471 ' CE2' ' HG3' ' A' ' 83' ' ' LYS . 0.5 OUTLIER -72.67 -41.19 65.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.089 -172.936 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -66.36 -30.97 71.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.433 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.405 ' CD ' HH21 ' A' ' 66' ' ' ARG . 14.1 tp10 -62.93 -47.48 83.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.037 174.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -61.63 -52.59 63.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.413 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.1 mt -63.32 -27.73 43.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.682 -175.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.405 HH21 ' CD ' ' A' ' 63' ' ' GLU . 46.4 ttp180 -73.49 -34.08 65.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.762 0.315 . . . . 0.0 111.346 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -99.14 -16.62 18.54 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -173.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.98 127.93 32.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.887 0.375 . . . . 0.0 110.057 178.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 p -85.12 -35.43 21.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.772 0.32 . . . . 0.0 110.935 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.449 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 15.5 m -58.61 116.19 14.33 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.616 -178.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 10.1 Cg_exo -71.99 -44.26 0.97 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.013 2.475 . . . . 0.0 112.529 -178.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.441 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 13.7 tpt -63.55 -42.92 98.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.413 -177.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 64.9 t -65.49 -41.15 90.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.901 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.8 -44.68 90.83 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.312 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.09 -34.81 64.1 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.978 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 72' ' ' MET . 0.7 OUTLIER -65.21 -45.9 82.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.171 -176.825 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -94.14 -2.04 53.3 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.009 0.433 . . . . 0.0 110.423 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.407 ' C ' ' H ' ' A' ' 80' ' ' ASP . . . -82.57 -51.26 4.39 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.298 -178.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.577 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 84.5 mtm-85 -82.68 25.3 0.66 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.33 0.586 . . . . 0.0 110.747 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.407 ' H ' ' C ' ' A' ' 78' ' ' GLY . 8.1 t70 -73.57 157.75 36.11 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.454 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 52.2 mtm180 -122.89 8.7 9.36 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.1 m -68.67 -28.04 66.51 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 170.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.613 ' HB2' ' CE1' ' A' ' 56' ' ' PHE . 25.5 mmtm -94.49 154.41 40.19 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.908 177.648 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.56 171.8 14.65 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.492 2.128 . . . . 0.0 112.791 -177.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 93.8 mt -126.94 173.41 9.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.309 0.576 . . . . 0.0 111.314 -178.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -84.28 152.73 23.98 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.022 177.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -78.89 -29.43 44.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.434 0.635 . . . . 0.0 109.76 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 22.3 p30 -92.18 13.53 18.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.604 176.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.577 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 42.5 t-105 -57.72 -29.58 64.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.55 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.563 ' HA ' ' HZ1' ' A' ' 93' ' ' LYS . 28.8 mm-40 -63.92 -37.58 87.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.319 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.3 t -90.35 -20.82 22.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.773 0.32 . . . . 0.0 111.837 -174.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.515 ' HA ' ' HB3' ' A' ' 95' ' ' GLN . 34.1 m -101.41 -6.05 9.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -170.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.577 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 57.3 mttp -52.62 -65.02 0.63 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.524 0.678 . . . . 0.0 110.752 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.661 ' OE2' ' HD3' ' A' ' 144' ' ' ARG . 34.9 mt-10 -86.75 -5.06 59.23 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.84 -175.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.515 ' HB3' ' HA ' ' A' ' 92' ' ' VAL . 8.6 tt0 -80.98 -47.36 13.74 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.489 175.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 53.3 t -65.9 -38.21 81.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.35 176.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.754 ' HG3' ' CH2' ' A' ' 133' ' ' TRP . 1.0 OUTLIER -61.81 -43.79 98.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.07 177.655 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -56.46 -44.93 81.0 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.175 0.512 . . . . 0.0 110.304 175.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -62.56 -43.39 98.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.562 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.83 80.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.139 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 69.2 mt -63.3 -43.57 97.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.585 177.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.426 ' HA ' HD21 ' A' ' 152' ' ' LEU . 76.5 ttt180 -62.79 -42.89 99.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.035 177.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.662 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -59.02 -45.3 91.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.609 177.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.618 ' HA ' HG21 ' A' ' 37' ' ' ILE . 37.2 ttmt -56.38 -58.84 6.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.297 -179.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.437 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 91.7 m-85 -80.09 -42.56 23.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -172.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -74.83 -22.51 58.66 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.982 -0.449 . . . . 0.0 111.497 -172.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.662 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.2 OUTLIER -83.5 -37.72 22.72 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.923 176.224 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.414 ' CE1' ' HE3' ' A' ' 35' ' ' TRP . 78.6 m-70 -98.36 104.56 16.61 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.77 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.79 -30.0 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.67 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -56.33 -52.04 66.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.543 0.687 . . . . 0.0 110.008 176.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 40.0 mt -78.87 -31.47 45.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.442 -176.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.735 ' HG3' HD12 ' A' ' 156' ' ' LEU . 18.9 ttt180 -63.03 -43.88 97.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.128 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.34 -35.64 78.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.444 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.442 HD12 ' HB2' ' A' ' 5' ' ' ALA . 36.1 tp -64.82 -42.82 94.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.404 178.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.487 HD21 HD13 ' A' ' 156' ' ' LEU . 61.0 tp -62.36 -41.2 98.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.209 0.528 . . . . 0.0 110.726 178.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 87.1 mt -77.7 -14.12 59.7 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.976 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -81.1 -34.61 32.48 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.544 176.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 22.9 p -75.14 -11.92 60.19 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.213 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.446 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -57.38 134.59 81.6 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.502 174.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.2 Cg_endo -106.24 69.37 0.23 Allowed 'Cis proline' 0 C--N 1.354 0.817 0 CA-C-N 118.917 0.649 . . . . 0.0 113.112 -5.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -88.85 158.4 18.12 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -88.19 105.95 17.87 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 176.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 29.5 mt -81.09 119.14 23.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.126 -173.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.524 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 47.3 t -134.95 123.6 41.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.9 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -98.85 137.09 37.92 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 172.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.415 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 81.1 t60 -98.91 77.56 2.22 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -177.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.413 ' C ' ' H ' ' A' ' 129' ' ' ASN . 5.7 t -100.01 94.98 6.55 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 122.298 1.047 . . . . 0.0 111.649 -173.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.478 ' HB3' ' HA3' ' A' ' 137' ' ' GLY . 3.0 pt-20 -83.27 14.36 3.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.894 170.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.413 ' H ' ' C ' ' A' ' 127' ' ' THR . 48.3 t-20 -82.37 -51.92 7.4 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.489 -1.232 . . . . 0.0 108.886 173.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -144.46 108.38 4.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.804 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.3 85.91 4.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.996 0.427 . . . . 0.0 111.182 -177.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.571 ' O ' ' HB3' ' A' ' 142' ' ' LYS . 35.5 t80 -169.17 -28.41 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.659 177.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.754 ' CH2' ' HG3' ' A' ' 97' ' ' MET . 47.3 m95 -111.8 77.22 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.529 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 112.39 -140.43 16.23 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 -178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -86.53 133.02 33.77 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 117.03 0.415 . . . . 0.0 110.222 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -84.55 32.33 3.4 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.127 -0.559 . . . . 0.0 112.804 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.478 ' HA3' ' HB3' ' A' ' 128' ' ' GLU . . . 80.95 13.45 81.2 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 121.185 -0.531 . . . . 0.0 114.091 174.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -154.35 12.15 0.41 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.955 0.877 . . . . 0.0 112.744 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 98.86 5.37 56.55 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 121.042 -0.599 . . . . 0.0 114.096 172.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -167.32 97.27 0.5 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 117.257 0.529 . . . . 0.0 111.253 176.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.33 -64.91 0.2 Allowed Glycine 0 C--N 1.31 -0.863 0 C-N-CA 120.481 -0.866 . . . . 0.0 111.332 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.571 ' HB3' ' O ' ' A' ' 132' ' ' TYR . 37.6 tttm -177.96 83.86 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.27 5.28 0.57 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.187 -174.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.661 ' HD3' ' OE2' ' A' ' 94' ' ' GLU . 51.2 ttt180 -62.48 -24.13 67.3 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -175.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.744 HD23 ' HB3' ' A' ' 133' ' ' TRP . 31.1 tp -58.57 -50.77 72.6 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 175.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.574 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -66.52 -28.62 73.84 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.925 176.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -68.78 -38.7 80.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.755 0.312 . . . . 0.0 110.328 177.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 96.3 mt -61.16 -37.55 83.28 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 174.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.9 -37.88 89.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.511 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.574 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 58.2 mtt -63.0 -51.77 65.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.875 0.369 . . . . 0.0 110.166 176.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -59.11 -44.41 91.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.459 -178.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.518 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 55.7 tp -67.11 -40.24 86.83 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.009 178.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.797 ' HB3' HH11 ' A' ' 153' ' ' ARG . 1.4 ttp-105 -57.8 -43.56 85.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.465 -179.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.18 -46.42 82.84 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.278 175.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.0 -51.39 69.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.518 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.735 HD12 ' HG3' ' A' ' 112' ' ' ARG . 20.9 mt -63.33 -30.78 71.85 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.909 -175.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.418 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -69.0 -48.15 63.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.324 175.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 162' ' ' GLU . 81.7 mt -64.01 -39.05 84.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.202 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -56.11 -47.21 78.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.978 0.418 . . . . 0.0 110.552 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -84.05 -15.95 45.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.117 0.484 . . . . 0.0 110.418 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 14.4 tp -72.38 -19.06 61.68 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 175.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 158' ' ' ILE . 42.0 mt-10 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.998 176.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 20.4 t . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -87.39 101.03 13.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.887 0.375 . . . . 0.0 111.013 -173.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.78 124.88 30.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.263 177.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 . . . . . 0 C--N 1.326 -0.445 0 CA-C-O 120.755 0.312 . . . . 0.0 110.362 -178.805 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.1 m170 . . . . . 0 N--CA 1.462 0.158 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.1 m -83.46 15.27 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.727 -173.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 38.5 mtm 63.94 40.9 6.98 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.537 171.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 70.43 -69.4 0.18 Allowed 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.709 0.631 . . . . 0.0 111.733 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -140.18 87.78 2.17 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.61 -174.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.4 t -101.65 142.08 33.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.119 176.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.421 ' N ' HD13 ' A' ' 16' ' ' ILE . 4.0 mp -96.15 105.61 17.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.4 mt -89.85 115.26 29.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.034 0.445 . . . . 0.0 110.347 -175.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.459 ' N ' HD21 ' A' ' 18' ' ' ASN . 0.9 OUTLIER -93.93 108.68 20.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.43 -177.22 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 31.4 p90 -114.25 113.79 25.09 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.086 0.47 . . . . 0.0 110.394 177.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.502 ' O ' ' HB2' ' A' ' 21' ' ' SER . 16.9 t80 -150.17 100.22 2.88 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 174.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.502 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 33.8 t 161.34 115.58 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.23 0 O-C-N 124.205 0.941 . . . . 0.0 109.008 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 m -87.94 2.47 51.56 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.241 0.543 . . . . 0.0 110.245 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.9 m -110.1 20.03 18.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.05 -177.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -126.29 157.63 37.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.966 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.91 -33.06 74.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.868 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -87.62 -1.52 58.01 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.6 0.714 . . . . 0.0 109.86 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.25 -0.29 56.61 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.261 -177.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.487 ' CG ' ' HZ2' ' A' ' 104' ' ' LYS . 23.1 t70 -51.69 -30.74 23.28 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -72.9 -0.79 14.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.734 0.302 . . . . 0.0 111.701 -177.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.9 t -75.06 139.78 43.05 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -77.63 -3.2 39.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.004 0.431 . . . . 0.0 110.573 178.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -106.77 12.01 29.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.37 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.2 137.14 57.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.855 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.94 58.18 2.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.297 0.57 . . . . 0.0 111.595 -174.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -112.0 118.81 45.62 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.966 177.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.78 134.53 35.2 Favored 'Trans proline' 0 C--O 1.239 0.534 0 C-N-CA 122.624 2.216 . . . . 0.0 111.501 175.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.549 HG21 ' HA ' ' A' ' 104' ' ' LYS . 29.8 pt -121.85 155.84 26.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.101 0.477 . . . . 0.0 110.925 -176.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.526 ' HE2' ' HA2' ' A' ' 41' ' ' GLY . 1.2 tmtp? -117.31 107.07 13.95 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 -178.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.426 ' C ' ' H ' ' A' ' 41' ' ' GLY . 7.7 t -127.21 127.88 69.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.072 -173.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 27.6 t70 73.64 -19.94 0.32 Allowed 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.712 0.633 . . . . 0.0 111.84 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.526 ' HA2' ' HE2' ' A' ' 38' ' ' LYS . . . 125.79 1.86 7.47 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 -171.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -109.52 134.98 51.25 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.241 -0.48 . . . . 0.0 110.1 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.3 m -84.17 116.5 22.95 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.167 176.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.451 ' HB2' HG13 ' A' ' 37' ' ' ILE . 80.0 m95 -106.06 130.74 22.51 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.837 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.65 -26.16 69.02 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.695 2.263 . . . . 0.0 112.945 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.803 ' HB ' ' OE1' ' A' ' 48' ' ' GLU . 0.1 OUTLIER -159.71 173.7 15.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.329 -178.044 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.0 m -77.87 -48.34 16.65 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -171.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.803 ' OE1' ' HB ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -59.94 -25.97 65.59 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.178 -178.844 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.522 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 54.3 m80 -59.82 -43.4 94.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.005 176.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -67.22 -44.69 78.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.945 0.402 . . . . 0.0 110.074 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -60.87 -46.59 90.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.638 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.456 ' CG ' ' HA3' ' A' ' 78' ' ' GLY . 2.4 tp-100 -65.08 -32.4 74.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.809 -177.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -73.74 -46.06 48.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.53 -178.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -77.83 -9.54 59.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.181 0.515 . . . . 0.0 110.756 -177.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.412 ' HA ' ' CZ3' ' A' ' 89' ' ' TRP . 86.8 tttt -63.43 -29.17 70.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.045 175.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -109.17 167.09 10.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.78 -177.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.425 HD13 ' HG2' ' A' ' 86' ' ' ARG . 5.2 mp -96.57 -37.19 10.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.934 -176.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.544 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 24.5 t70 -63.38 126.63 28.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.822 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.63 -32.37 67.88 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -173.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.8 ttpp -64.35 -40.9 96.77 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.456 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 0.5 OUTLIER -66.45 -32.25 73.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.712 -179.628 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.544 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 65.0 mtt180 -63.67 -45.2 91.21 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.368 0.604 . . . . 0.0 109.556 176.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -77.59 -16.36 58.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.386 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.456 ' HB2' ' HA ' ' A' ' 61' ' ' TYR . 6.3 tp10 -66.82 -45.81 77.13 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.523 ' O ' HG13 ' A' ' 68' ' ' VAL . 1.9 mp -70.79 -31.4 45.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.731 175.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -72.57 -11.54 60.69 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.009 0.433 . . . . 0.0 110.644 175.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -85.24 -7.95 58.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.132 0.491 . . . . 0.0 110.402 -177.901 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.523 HG13 ' O ' ' A' ' 65' ' ' ILE . 7.5 p -115.36 138.43 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.792 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 39.3 t -90.35 -32.41 16.48 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.798 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.44 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 31.4 t -68.71 121.41 81.06 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.708 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.522 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 22.4 Cg_exo -66.05 -32.83 43.15 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.121 2.547 . . . . 0.0 112.26 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 46.3 ttm -67.8 -41.44 83.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.696 -177.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.505 ' HB ' HG23 ' A' ' 68' ' ' VAL . 87.1 t -66.3 -36.2 76.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.447 178.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.43 -44.28 95.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.247 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.412 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -63.44 -39.43 94.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.73 177.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -56.51 -53.84 52.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.693 178.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 54.0 mtm -70.56 -30.54 67.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.914 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.456 ' HA3' ' CG ' ' A' ' 52' ' ' GLN . . . -81.95 -7.22 88.19 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.943 -178.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 40.9 ttt180 -89.24 -0.94 57.85 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 122.539 -0.389 . . . . 0.0 110.627 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.431 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 30.2 t70 -71.12 112.38 7.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.047 0.451 . . . . 0.0 110.499 -179.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -96.16 10.82 36.5 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.325 0.583 . . . . 0.0 110.16 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 m -74.13 -24.4 59.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.643 176.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.431 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 49.2 mmtm -75.78 147.0 80.62 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.576 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -62.51 120.58 8.18 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.319 2.013 . . . . 0.0 111.215 173.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 89.4 mt -86.74 150.95 23.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.804 -176.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.553 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 22.7 mtp180 -68.83 130.63 43.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.36 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -58.06 -43.09 86.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.976 0.417 . . . . 0.0 111.603 -177.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -103.32 33.23 3.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.835 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.553 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 43.8 t-105 -60.09 -40.11 88.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.776 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.447 ' HA ' ' HE3' ' A' ' 93' ' ' LYS . 12.4 pt-20 -68.23 -23.38 64.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.697 0.284 . . . . 0.0 111.211 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.0 m -84.38 -20.15 32.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.15 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.6 m -114.3 6.99 7.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 110.607 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.447 ' HE3' ' HA ' ' A' ' 90' ' ' GLU . 38.4 ttmt -58.78 -53.01 63.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.649 -176.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -25.5 49.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.469 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.794 ' HA ' ' HD2' ' A' ' 98' ' ' ARG . 34.0 tt0 -58.68 -56.06 27.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.631 174.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.9 -43.99 96.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.823 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 47.0 ttm -65.05 -43.92 90.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.774 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.794 ' HD2' ' HA ' ' A' ' 95' ' ' GLN . 0.8 OUTLIER -66.65 -29.32 69.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.441 -178.535 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.44 ' N ' ' HG2' ' A' ' 98' ' ' ARG . 88.3 tttt -71.12 -42.79 68.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.021 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.62 87.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.428 176.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' A' ' 101' ' ' LEU . 22.4 mt -60.91 -41.76 96.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.227 178.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.664 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 58.4 ttt180 -61.01 -48.65 80.83 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 120.383 -0.527 . . . . 0.0 109.882 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -55.9 -36.69 67.94 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.115 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.549 ' HA ' HG21 ' A' ' 37' ' ' ILE . 63.5 tttm -59.21 -50.61 73.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.171 178.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -81.79 -26.21 34.6 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -177.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.664 ' HG3' ' HG2' ' A' ' 102' ' ' ARG . 5.9 mm-40 -74.98 -35.79 62.04 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.729 0.3 . . . . 0.0 111.759 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.51 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 77.2 mm-40 -84.21 -11.46 56.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.985 0.422 . . . . 0.0 110.905 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -129.2 99.21 5.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.811 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -59.67 -29.9 68.39 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.486 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . 0.452 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.9 mp0 -53.26 -51.79 61.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.074 175.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.49 HD13 ' HZ3' ' A' ' 104' ' ' LYS . 29.0 mt -75.42 -33.7 60.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.48 -176.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 24.6 ttt-85 -57.96 -41.77 83.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.114 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.7 -43.12 73.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.792 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 63.7 tp -57.11 -44.28 83.11 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.784 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.424 HD23 HD13 ' A' ' 156' ' ' LEU . 40.5 tp -62.76 -45.89 90.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.274 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.502 HD21 ' HB2' ' A' ' 156' ' ' LEU . 79.0 mt -70.37 -18.28 63.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.719 0.295 . . . . 0.0 111.629 -176.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -73.9 -21.9 59.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.631 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.1 p -75.67 -27.28 58.26 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -176.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.526 ' HB1' ' HD2' ' A' ' 153' ' ' ARG . . . -48.78 137.78 12.76 Favored Pre-proline 0 N--CA 1.467 0.379 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -100.75 33.74 8.3 Favored 'Cis proline' 0 N--CA 1.458 -0.588 0 C-N-CA 124.554 -1.019 . . . . 0.0 112.941 -2.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -62.84 159.42 16.65 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.976 0.417 . . . . 0.0 111.688 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -90.5 119.05 30.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.114 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.407 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 60.5 mt -86.4 113.48 22.39 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.757 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 95.7 t -131.9 126.8 57.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.084 0.469 . . . . 0.0 111.285 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.562 ' OE1' ' HA3' ' A' ' 134' ' ' GLY . 0.0 OUTLIER -83.31 141.73 31.6 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 172.777 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -120.04 77.51 1.25 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.374 -174.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.435 ' HG1' ' CD ' ' A' ' 125' ' ' GLU . 2.2 m -78.33 137.49 38.08 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.601 171.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 45.6 mp0 -120.49 -1.36 10.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.74 0.305 . . . . 0.0 110.658 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -94.57 -5.43 45.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.885 0.374 . . . . 0.0 111.297 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . 0.785 ' O ' ' HA2' ' A' ' 136' ' ' GLY . 4.8 t70 -178.48 -165.01 0.08 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.06 86.2 2.23 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.88 0.371 . . . . 0.0 110.133 175.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.528 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 4.7 t80 -155.13 122.29 5.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.584 -175.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.436 ' HZ2' ' HG2' ' A' ' 93' ' ' LYS . 28.8 m95 64.03 20.62 12.28 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.78 0.675 . . . . 0.0 112.513 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.562 ' HA3' ' OE1' ' A' ' 125' ' ' GLU . . . -176.01 -114.85 0.39 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.232 -0.985 . . . . 0.0 112.279 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -112.79 173.14 6.52 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 120.698 0.285 . . . . 0.0 110.794 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . 0.785 ' HA2' ' O ' ' A' ' 130' ' ' ASP . . . -120.95 21.11 8.42 Favored Glycine 0 N--CA 1.444 -0.821 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 175.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.6 44.12 4.99 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.425 -0.417 . . . . 0.0 113.26 178.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -174.15 -35.34 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 117.164 0.482 . . . . 0.0 112.207 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 131.01 36.41 0.35 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.893 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt 179.32 89.99 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.816 0.341 . . . . 0.0 110.804 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.575 ' O ' ' HG3' ' A' ' 142' ' ' LYS . . . -123.93 -65.13 0.2 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 119.664 -1.255 . . . . 0.0 112.124 174.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 141' ' ' GLY . 47.6 mttp -166.17 79.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 123.697 0.799 . . . . 0.0 109.2 177.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.1 4.99 2.32 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.511 -173.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.679 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 6.9 tpp180 -49.63 -38.64 32.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.226 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.56 -58.5 7.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.962 -178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 123' ' ' LEU . . . -62.49 -29.88 74.8 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.945 -0.645 . . . . 0.0 111.752 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . 0.416 ' O ' ' HG2' ' A' ' 151' ' ' GLU . 11.4 t80 -67.21 -40.67 86.45 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.679 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.1 mt -61.06 -41.49 96.7 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.895 0.379 . . . . 0.0 110.174 175.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.8 mt -61.15 -36.76 80.64 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.863 177.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 77.8 mtm -77.58 -34.78 53.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.972 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 147' ' ' TYR . 7.3 mm-40 -59.72 -48.26 82.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.457 0.646 . . . . 0.0 109.48 172.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.517 HD13 ' HG3' ' A' ' 102' ' ' ARG . 54.3 tp -64.56 -37.63 88.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.793 179.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.665 HH11 ' HG2' ' A' ' 153' ' ' ARG . 30.9 ttp85 -61.04 -41.34 96.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.988 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -67.28 -33.95 76.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.084 0.468 . . . . 0.0 110.461 176.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -65.32 -53.18 47.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.901 177.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 55.2 mt -68.0 -23.59 65.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.93 -175.029 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.507 ' O ' ' HB3' ' A' ' 160' ' ' LYS . . . -64.43 -48.81 73.92 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.494 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.08 -37.42 80.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.771 0.319 . . . . 0.0 110.616 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.69 -24.19 66.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.019 0.438 . . . . 0.0 110.725 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . 0.507 ' HB3' ' O ' ' A' ' 157' ' ' ALA . 53.3 tttp -68.1 -26.73 65.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.257 176.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.4 mp -78.64 -35.69 45.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.248 0.547 . . . . 0.0 109.935 176.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.435 -178.321 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.7 p . . . . . 0 CA--C 1.535 0.372 0 CA-C-O 121.902 0.858 . . . . 0.0 109.988 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.513 ' HB3' ' CG ' ' A' ' 25' ' ' ASP . 42.3 ttm105 -105.6 37.89 2.12 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.772 0.796 . . . . 0.0 110.195 -176.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.422 ' HB2' HD11 ' A' ' 114' ' ' LEU . . . -78.37 29.4 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.2 -176.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 . . . . . 0 C--N 1.326 -0.423 0 CA-C-O 120.785 0.326 . . . . 0.0 110.789 -179.741 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 . . . . . 0 N--CA 1.469 0.493 0 CA-C-O 121.332 0.587 . . . . 0.0 111.588 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.54 HG22 ' HB3' ' A' ' 121' ' ' ALA . 34.4 m -68.59 163.14 3.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.542 176.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.428 ' SD ' ' N ' ' A' ' 12' ' ' MET . 0.0 OUTLIER -81.2 -79.9 0.15 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.814 -173.831 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.0 tp60 -171.46 119.74 0.47 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.391 -0.822 . . . . 0.0 108.925 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.8 t70 59.58 88.11 0.08 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.596 0.713 . . . . 0.0 110.198 -172.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.534 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 9.2 m -134.44 117.02 15.82 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.582 -179.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.452 ' N ' HD12 ' A' ' 16' ' ' ILE . 4.2 mp -82.95 100.77 6.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.458 HD13 HG12 ' A' ' 11' ' ' VAL . 62.9 mt -89.81 108.75 19.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.266 -177.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.608 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 0.9 OUTLIER -92.81 106.64 18.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.598 179.436 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.64 ' CE2' ' HB2' ' A' ' 125' ' ' GLU . 39.6 p90 -105.02 151.33 24.08 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 174.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.659 ' CE1' ' HA ' ' A' ' 127' ' ' THR . 1.7 t80 -150.1 108.04 3.72 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.436 -0.505 . . . . 0.0 111.923 -176.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.7 m 73.68 171.14 0.3 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.614 0.721 . . . . 0.0 112.247 173.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.0 p -82.43 3.05 29.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.997 -1.001 . . . . 0.0 112.222 -172.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.7 p -76.12 23.39 0.14 Allowed 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -174.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -156.92 163.66 38.9 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 -178.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.513 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 5.7 m-20 -61.24 -35.71 77.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.264 0.554 . . . . 0.0 109.901 175.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.429 ' CE1' HD13 ' A' ' 114' ' ' LEU . 92.2 m-85 -77.74 -1.95 33.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.354 177.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.27 -4.15 67.8 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.08 177.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.521 ' CG ' ' HZ3' ' A' ' 104' ' ' LYS . 24.2 t70 -68.78 -22.85 64.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.423 0.63 . . . . 0.0 110.093 174.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -68.5 -24.86 64.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.475 176.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.0 m -71.98 134.11 45.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.739 175.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.482 ' HB2' ' HE2' ' A' ' 97' ' ' MET . 5.0 p30 -54.97 -23.63 20.14 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -174.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.62 -52.96 17.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 176.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 42.25 -157.2 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.863 0.865 . . . . 0.0 112.992 -176.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -157.86 22.63 0.27 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.737 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 84.1 m95 -112.99 125.58 29.58 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.935 -177.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 24.5 Cg_exo -64.38 143.24 82.04 Favored 'Trans proline' 0 C--O 1.238 0.485 0 C-N-CA 122.844 2.363 . . . . 0.0 112.41 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.609 HG21 ' HA ' ' A' ' 104' ' ' LYS . 32.2 pt -121.92 153.0 25.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.523 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.415 ' HE3' ' O ' ' A' ' 41' ' ' GLY . 37.9 tptt -116.17 95.43 5.08 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 t -107.81 117.42 53.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.291 -178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.6 t70 69.13 5.01 4.84 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.584 0.707 . . . . 0.0 110.632 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.415 ' O ' ' HE3' ' A' ' 38' ' ' LYS . . . 104.67 -2.34 42.18 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.469 -175.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 51.6 mttm -94.25 125.45 38.89 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.631 ' HB ' HH21 ' A' ' 66' ' ' ARG . 35.2 m -82.82 109.72 17.21 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.863 0.363 . . . . 0.0 110.602 178.073 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.426 ' HB2' ' CG1' ' A' ' 37' ' ' ILE . 57.6 m95 -101.84 129.04 27.37 Favored Pre-proline 0 C--N 1.318 -0.773 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 174.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.458 ' CG ' ' HA ' ' A' ' 69' ' ' SER . 52.4 Cg_exo -53.78 -22.57 23.77 Favored 'Trans proline' 0 N--CA 1.475 0.431 0 C-N-CA 123.026 2.484 . . . . 0.0 113.338 -176.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 15.4 t -179.31 173.37 1.12 Allowed 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 175.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.73 -32.57 71.83 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -175.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -50.02 -43.37 50.68 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.559 0.343 . . . . 0.0 111.335 175.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -69.13 -30.13 68.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.168 -175.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -76.02 -31.65 59.0 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -64.02 -52.38 59.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.948 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -63.6 -41.03 98.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.653 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.796 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -67.04 -27.69 67.61 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -100.49 -7.15 24.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.657 0.265 . . . . 0.0 110.988 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.538 ' HA ' ' CZ3' ' A' ' 89' ' ' TRP . 83.2 tttt -62.62 -39.59 94.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.333 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -107.36 160.79 15.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.115 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.667 HD21 ' H ' ' A' ' 57' ' ' LEU . 1.6 pt? -95.73 28.9 2.84 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 168.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -97.68 106.58 18.91 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.105 -1.407 . . . . 0.0 109.895 -176.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.476 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 2.4 mp0 -64.69 -35.8 82.2 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.346 -178.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -63.79 -47.6 80.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.797 0.332 . . . . 0.0 110.809 -177.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.532 ' O ' HG12 ' A' ' 65' ' ' ILE . 0.1 OUTLIER -68.77 -29.55 67.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.367 -178.145 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.796 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 38.4 ttm180 -60.99 -41.9 97.38 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.127 0.489 . . . . 0.0 109.754 176.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 45.0 mt-10 -65.7 -39.51 91.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.117 176.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.26 -36.99 63.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.154 -174.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 61' ' ' TYR . 41.1 mm -63.56 -33.47 61.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 174.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.631 HH21 ' HB ' ' A' ' 43' ' ' THR . 0.4 OUTLIER -73.25 -25.31 60.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.271 178.04 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 58.0 mtt-85 -70.28 -33.24 71.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.643 0.259 . . . . 0.0 111.204 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.4 m -92.29 134.88 29.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.239 0.542 . . . . 0.0 111.417 -175.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.458 ' HA ' ' CG ' ' A' ' 45' ' ' PRO . 5.0 p -88.78 -21.32 23.85 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.479 175.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 44.5 t -78.47 126.18 83.42 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.741 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -72.34 -32.29 10.46 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.636 2.224 . . . . 0.0 112.008 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.9 tpt -69.82 -38.36 76.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.266 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 95.5 t -68.32 -39.09 80.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.565 177.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.98 -52.2 57.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.658 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.14 -35.77 74.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.044 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 30.5 ttt85 -62.33 -39.98 94.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.742 0.306 . . . . 0.0 110.689 177.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.439 ' HE3' HD11 ' A' ' 65' ' ' ILE . 72.4 mtm -74.02 -34.93 64.32 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.03 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.49 6.37 77.74 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.469 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -63.25 -42.3 99.16 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -86.95 176.9 7.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.831 0.348 . . . . 0.0 111.482 -170.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -115.18 5.42 14.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.046 -174.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 49.9 m -64.75 -27.3 68.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.884 0.373 . . . . 0.0 111.294 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.491 ' HE3' ' CE2' ' A' ' 61' ' ' TYR . 0.2 OUTLIER -89.49 147.22 37.48 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -50.27 112.55 0.76 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.164 2.576 . . . . 0.0 113.97 -173.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 97.0 mt -88.47 155.17 19.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.023 175.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 -95.76 143.77 26.71 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.747 0.308 . . . . 0.0 110.497 -178.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -79.45 -28.64 41.62 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.177 0.513 . . . . 0.0 110.28 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -85.47 11.9 9.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.621 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.538 ' CZ3' ' HA ' ' A' ' 55' ' ' LYS . 60.7 t-105 -60.39 -19.45 55.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.333 0.587 . . . . 0.0 110.138 176.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.597 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 17.9 mm-40 -68.11 -40.38 82.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.488 175.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.0 p -100.02 -1.0 38.12 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -172.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.476 HG23 ' HA ' ' A' ' 89' ' ' TRP . 34.7 m -112.37 0.8 8.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -177.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.597 ' NZ ' ' HA ' ' A' ' 90' ' ' GLU . 50.7 mttp -61.04 -54.92 38.83 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.286 0.565 . . . . 0.0 109.944 179.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -67.74 -28.66 67.83 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.471 -178.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -69.94 -54.09 14.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.744 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.4 t -62.22 -43.99 98.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.636 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.482 ' HE2' ' HB2' ' A' ' 31' ' ' ASN . 0.8 OUTLIER -60.09 -50.15 74.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.886 178.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.5 ttm-85 -60.01 -43.11 95.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.899 0.381 . . . . 0.0 110.866 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -66.48 -48.01 71.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.919 -178.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.11 -37.98 89.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.88 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.417 HD13 ' CD2' ' A' ' 149' ' ' LEU . 90.0 mt -67.5 -43.06 81.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.107 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.515 ' HG3' HD11 ' A' ' 152' ' ' LEU . 10.9 ttt-85 -61.55 -46.55 89.46 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.956 178.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.521 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -63.91 -24.48 67.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.097 -179.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.609 ' HA ' HG21 ' A' ' 37' ' ' ILE . 28.1 ttpp -76.74 -49.6 15.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.547 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.585 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 77.4 m-85 -71.6 -27.55 63.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.327 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.425 ' HA ' HH11 ' A' ' 112' ' ' ARG . 25.6 mt-10 -73.83 -35.4 64.84 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.613 173.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 7.8 tp-100 -66.81 -34.66 78.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.061 -177.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.445 ' HB3' ' OE2' ' A' ' 110' ' ' GLU . 97.0 m-70 -121.4 109.59 15.06 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.459 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.76 -33.25 73.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.778 -177.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . 0.445 ' OE2' ' HB3' ' A' ' 108' ' ' HIS . 1.0 OUTLIER -72.44 -29.9 64.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.77 -179.044 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 76.2 mt -74.61 -38.64 62.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.04 0.447 . . . . 0.0 109.893 175.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.585 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 30.6 ttp-105 -62.89 -43.53 98.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.045 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.69 72.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.722 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.429 HD13 ' CE1' ' A' ' 26' ' ' TYR . 66.4 tp -66.27 -48.17 71.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.943 0.401 . . . . 0.0 110.257 176.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.464 HD21 HD12 ' A' ' 156' ' ' LEU . 42.7 tp -59.41 -44.89 92.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.013 178.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 51.3 mt -74.94 -15.96 60.66 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.476 -177.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.3 -21.14 56.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.894 0.378 . . . . 0.0 110.752 176.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 43.8 p -85.97 -5.95 59.13 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 121.05 0.453 . . . . 0.0 110.559 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.07 143.21 65.3 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.282 174.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -99.34 46.56 2.36 Favored 'Cis proline' 0 N--CA 1.456 -0.687 0 C-N-CA 124.397 -1.085 . . . . 0.0 113.56 -0.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.54 ' HB3' HG22 ' A' ' 11' ' ' VAL . . . -78.73 176.53 9.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.588 0.232 . . . . 0.0 110.761 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.403 ' HG3' ' SD ' ' A' ' 150' ' ' MET . 35.1 ttpt -108.69 127.82 54.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.271 -176.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 27.8 mt -93.16 120.46 33.48 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.27 -172.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.608 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 99.0 t -139.42 120.3 15.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.047 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.64 ' HB2' ' CE2' ' A' ' 19' ' ' PHE . 31.8 tt0 -93.88 129.86 40.15 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 172.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.463 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 8.4 t60 -97.63 77.6 2.58 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -176.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.659 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -77.17 92.22 3.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.065 -179.859 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.408 ' HB2' ' HD2' ' A' ' 126' ' ' HIS . 20.3 tt0 -95.53 -15.01 23.16 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.225 -174.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -88.61 -34.08 17.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.542 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . 0.531 ' O ' ' HB ' ' A' ' 127' ' ' THR . 34.3 t70 -142.19 110.28 5.93 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.101 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.514 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -79.09 85.94 4.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.919 -172.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.495 ' CE2' ' HD3' ' A' ' 142' ' ' LYS . 7.4 t80 -169.55 147.36 3.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.522 172.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.48 ' HB3' HD21 ' A' ' 145' ' ' LEU . 18.5 m95 68.53 13.6 8.97 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 123.746 0.654 . . . . 0.0 111.693 178.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -160.44 -155.59 7.83 Favored Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 119.929 -1.129 . . . . 0.0 112.71 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.463 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 15.3 t70 -66.43 -29.02 69.07 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.224 0.535 . . . . 0.0 110.696 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . 0.612 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 78.06 0.41 76.2 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.62 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.43 ' HA2' ' NE2' ' A' ' 126' ' ' HIS . . . 88.26 9.37 70.13 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.491 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -170.3 25.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 111.186 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 86.54 -51.97 4.41 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.288 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -88.67 65.25 7.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.3 0.572 . . . . 0.0 111.119 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.612 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -123.32 14.49 8.25 Favored Glycine 0 C--N 1.315 -0.616 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.379 173.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.495 ' HD3' ' CE2' ' A' ' 132' ' ' TYR . 22.2 mtpp 61.36 79.9 0.24 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.211 0.604 . . . . 0.0 111.071 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -75.38 5.33 5.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.276 -176.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.655 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 1.2 ttm180 -32.76 -37.42 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.43 1.092 . . . . 0.0 112.665 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 133' ' ' TRP . 45.4 tp -61.37 -52.65 63.76 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.611 0.243 . . . . 0.0 111.126 -178.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -63.17 -27.01 69.88 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.701 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . 0.489 ' HA ' ' HE1' ' A' ' 150' ' ' MET . 70.9 t80 -71.33 -43.34 67.2 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.655 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 75.1 mt -61.71 -41.21 97.3 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 175.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.417 ' CD2' HD13 ' A' ' 101' ' ' LEU . 60.8 mt -61.3 -38.83 88.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.813 175.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.489 ' HE1' ' HA ' ' A' ' 147' ' ' TYR . 62.4 mtm -70.09 -38.95 75.82 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.212 178.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.0 -46.13 90.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.026 0.441 . . . . 0.0 109.887 174.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.515 HD11 ' HG3' ' A' ' 102' ' ' ARG . 45.7 tp -63.29 -42.06 99.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.642 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.926 ' HB3' HH11 ' A' ' 153' ' ' ARG . 1.0 OUTLIER -60.01 -42.49 94.39 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.672 176.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.63 -44.68 93.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.226 0.536 . . . . 0.0 109.858 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -65.12 -41.42 94.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.143 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.464 HD12 HD21 ' A' ' 115' ' ' LEU . 79.3 mt -76.28 -22.57 54.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.706 -0.225 . . . . 0.0 110.569 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -67.24 -44.37 79.63 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 172.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 75.2 mt -63.6 -40.12 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.876 174.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -63.52 -32.42 73.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.217 177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -74.58 -44.07 52.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.795 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.12 -16.93 49.68 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.641 175.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.544 177.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.446 HG23 ' HB3' ' A' ' 110' ' ' GLU . 8.4 p . . . . . 0 N--CA 1.469 0.511 0 CA-C-O 122.285 1.041 . . . . 0.0 113.187 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -101.66 -31.91 10.58 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.889 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 56.0 68.79 0.81 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.513 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.432 178.604 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 120.693 0.282 . . . . 0.0 111.523 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.721 HG21 ' HD2' ' A' ' 120' ' ' PRO . 9.0 m -89.65 163.83 2.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.452 ' HE1' ' HG1' ' A' ' 15' ' ' THR . 21.0 mtm -125.26 18.19 8.31 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.594 0.235 . . . . 0.0 110.791 -174.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' A' ' 15' ' ' THR . 27.1 mt-30 69.18 -60.21 0.46 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.168 -176.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -79.23 24.33 0.34 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.705 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.452 ' HG1' ' HE1' ' A' ' 12' ' ' MET . 11.8 m -83.13 103.25 12.4 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.311 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.535 HG12 ' HB3' ' A' ' 122' ' ' LYS . 28.4 mt -100.88 108.73 23.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 175.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -92.35 111.6 24.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.413 -174.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.615 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 16.8 m120 -99.61 116.46 31.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.076 -178.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.444 ' O ' ' HG3' ' A' ' 125' ' ' GLU . 28.8 p90 -112.36 174.44 5.88 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.238 178.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.404 ' C ' ' HG ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -142.16 100.57 3.75 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.094 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.404 ' HG ' ' C ' ' A' ' 20' ' ' TYR . 67.7 p 49.17 -144.39 0.46 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 123.778 0.674 . . . . 0.0 110.967 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.659 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 17.0 p -76.01 -77.16 0.14 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.45 -179.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.8 m 68.16 -61.09 0.4 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.107 0.563 . . . . 0.0 112.163 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.442 ' CG ' ' H ' ' A' ' 25' ' ' ASP . 9.5 t70 -132.04 -164.7 1.49 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -175.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.442 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 28.3 t70 -71.25 -20.05 62.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.458 0.647 . . . . 0.0 110.242 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -77.77 -5.66 51.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.505 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.659 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -71.28 -0.85 39.32 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.892 -0.595 . . . . 0.0 114.026 -174.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.41 -24.48 60.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.011 0.434 . . . . 0.0 111.658 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -66.1 -13.3 59.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.431 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.2 t -86.56 131.78 34.08 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 174.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -75.5 8.7 2.64 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -176.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -98.52 4.2 48.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.366 0.603 . . . . 0.0 109.636 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.14 138.0 49.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.474 177.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.426 ' HA ' ' CG2' ' A' ' 46' ' ' THR . . . -86.35 60.65 6.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.18 0.514 . . . . 0.0 111.613 -173.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -101.95 113.05 65.97 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.12 175.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.84 132.83 44.41 Favored 'Trans proline' 0 C--O 1.239 0.531 0 C-N-CA 122.776 2.318 . . . . 0.0 112.35 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.496 HG13 ' HB2' ' A' ' 44' ' ' TRP . 12.4 pt -126.11 130.34 72.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.523 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -86.78 98.68 11.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.417 177.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.0 t -126.16 129.13 72.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.97 -174.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 59.68 20.63 9.31 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.812 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 108.46 -14.26 35.89 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.584 -0.817 . . . . 0.0 113.551 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.6 tptm -124.79 161.84 25.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 117.938 0.869 . . . . 0.0 110.922 -172.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.5 m -96.71 115.44 27.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.898 0.38 . . . . 0.0 110.604 -177.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.496 ' HB2' HG13 ' A' ' 37' ' ' ILE . 67.4 m95 -96.65 129.33 33.25 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.688 178.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 27.3 Cg_exo -64.43 -25.61 63.34 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 123.185 2.59 . . . . 0.0 113.082 -176.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.426 ' CG2' ' HA ' ' A' ' 34' ' ' ALA . 0.9 OUTLIER -155.38 162.05 40.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.092 -178.566 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.2 m -66.15 -36.93 84.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.591 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -23.1 62.62 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -175.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -62.94 -45.14 93.88 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.88 0.371 . . . . 0.0 110.461 175.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -70.1 -41.99 73.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.509 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -59.61 -44.31 93.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.662 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.623 ' HG3' ' HA3' ' A' ' 78' ' ' GLY . 0.0 OUTLIER -69.53 -36.16 76.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.691 0.282 . . . . 0.0 110.95 -179.857 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.4 ' HB3' ' HG3' ' A' ' 62' ' ' ARG . . . -70.17 -39.06 75.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.925 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -81.53 -18.93 43.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.871 0.367 . . . . 0.0 110.733 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -59.7 -31.63 69.77 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.027 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.431 ' CE1' ' HA2' ' A' ' 78' ' ' GLY . 88.8 m-85 -95.71 132.38 40.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.772 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.93 0.85 56.25 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.443 0.64 . . . . 0.0 109.681 170.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -84.96 111.04 19.33 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 170.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.561 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 40.5 mt-10 -77.31 -10.87 59.7 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.714 -172.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -73.57 -45.01 55.89 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -66.21 -38.26 87.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.58 172.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.4 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 40.2 ttp180 -61.03 -38.41 86.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.653 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 48.9 mm-40 -60.72 -48.15 83.08 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.386 174.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.18 -49.56 76.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.835 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.519 HG12 ' HE3' ' A' ' 77' ' ' MET . 74.7 mt -64.15 -27.8 43.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.556 -176.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 66' ' ' ARG . 41.3 ttp-105 -77.11 -23.73 51.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.735 0.303 . . . . 0.0 111.259 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 23.8 mtm180 -93.71 -14.64 26.1 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -174.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.0 m -85.75 131.44 34.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.246 0.546 . . . . 0.0 111.069 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.1 t -87.97 -7.11 57.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.751 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.42 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.5 m -87.59 116.05 64.86 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.252 -177.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 16.9 Cg_exo -69.03 -51.41 0.45 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.037 2.492 . . . . 0.0 112.551 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 86.2 mtp -63.02 -38.62 91.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 111.044 -175.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 61.1 t -64.59 -39.07 84.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.486 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -51.05 55.17 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.643 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -57.91 -39.77 78.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.56 -178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -65.71 -53.72 37.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.68 0.276 . . . . 0.0 111.234 -177.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.519 ' HE3' HG12 ' A' ' 65' ' ' ILE . 27.1 ptt? -76.14 -18.96 58.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.937 0.399 . . . . 0.0 110.699 -177.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.623 ' HA3' ' HG3' ' A' ' 52' ' ' GLN . . . -83.22 -21.58 58.54 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.753 -0.737 . . . . 0.0 111.98 178.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.6 ttm105 -73.35 -9.22 58.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.149 0.5 . . . . 0.0 110.437 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.614 ' OD1' ' HG2' ' A' ' 83' ' ' LYS . 10.2 t70 -51.92 131.95 31.64 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.154 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.592 ' HD3' ' O ' ' A' ' 81' ' ' ARG . 4.5 tmt_? -112.46 -7.42 13.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.184 0.516 . . . . 0.0 110.073 -177.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.2 m -79.87 -19.02 49.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.189 0.518 . . . . 0.0 110.272 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.614 ' HG2' ' OD1' ' A' ' 80' ' ' ASP . 42.5 mmtm -75.1 161.94 75.26 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.375 176.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.532 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 32.0 Cg_endo -64.36 115.21 3.04 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.231 1.954 . . . . 0.0 111.991 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.409 HD12 ' HG2' ' A' ' 81' ' ' ARG . 96.0 mt -90.0 166.96 13.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.021 178.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -86.0 142.81 28.5 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -178.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -58.54 -48.5 80.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.397 . . . . 0.0 110.834 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -96.44 32.87 1.9 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.985 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.485 ' O ' ' HB2' ' A' ' 93' ' ' LYS . 19.2 t-105 -55.67 -44.08 76.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.028 -178.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.16 -18.94 64.0 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.007 0.432 . . . . 0.0 111.33 -177.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.0 m -90.14 -43.37 10.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.666 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.2 m -79.16 -17.25 13.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.621 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 89' ' ' TRP . 21.4 tttp -50.49 -50.16 53.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.458 0.647 . . . . 0.0 110.279 176.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -63.28 -38.23 90.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.676 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -79.74 -42.2 25.08 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.515 -173.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.7 t -61.62 -41.76 91.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.871 0.367 . . . . 0.0 110.115 177.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 49.0 tpp -62.44 -45.48 92.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.397 177.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -63.85 -38.13 89.96 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.8 178.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -61.79 -44.99 95.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.76 0.314 . . . . 0.0 110.395 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.79 -44.98 79.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.723 177.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.7 mt -59.52 -49.54 77.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.194 178.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -59.77 -48.56 81.2 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.557 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.88 -39.07 73.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.958 0.409 . . . . 0.0 110.629 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.81 -46.4 58.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.253 -175.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -82.02 -38.53 24.89 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -76.97 -33.93 57.61 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 122.086 -0.384 . . . . 0.0 111.577 -173.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -83.83 -2.8 57.12 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.141 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 65.7 m-70 -126.4 100.25 6.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.463 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.4 -32.0 66.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.89 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . 0.446 ' HB3' HG23 ' A' ' 3' ' ' VAL . 1.4 mp0 -56.64 -50.6 71.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.089 177.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.73 -31.47 57.16 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.509 -173.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -59.15 -44.41 92.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.959 175.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.97 -46.85 89.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.655 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 56.5 tp -59.19 -47.81 83.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.848 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.429 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 48.9 tp -62.47 -50.58 70.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.479 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.513 HD12 ' HB2' ' A' ' 156' ' ' LEU . 10.6 mp -70.95 -13.33 61.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.918 -175.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.83 -22.78 60.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.762 -0.199 . . . . 0.0 111.241 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 47.5 p -78.72 -29.99 45.66 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.561 -177.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.449 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -51.29 136.57 30.46 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . 0.721 ' HD2' HG21 ' A' ' 11' ' ' VAL . 85.4 Cg_endo -101.39 42.57 3.19 Favored 'Cis proline' 0 CA--C 1.537 0.642 0 C-N-CA 124.757 -0.934 . . . . 0.0 113.152 -3.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.98 159.11 34.37 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 122.167 -0.333 . . . . 0.0 110.973 178.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.535 ' HB3' HG12 ' A' ' 16' ' ' ILE . 35.5 ttmt -89.49 121.09 31.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.836 0.35 . . . . 0.0 110.487 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 70.1 mt -89.67 108.82 19.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.718 -178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.615 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 96.1 t -137.91 117.31 14.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.523 -179.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 19' ' ' PHE . 44.9 tt0 -89.4 110.62 21.41 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 173.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.475 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 86.1 t60 -82.44 77.33 9.23 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 98.8 m -92.05 99.14 12.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 174.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.426 ' HG3' ' HA3' ' A' ' 137' ' ' GLY . 19.7 tt0 -79.37 -15.94 57.07 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.139 -171.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.413 ' O ' ' HB2' ' A' ' 130' ' ' ASP . 12.9 m120 -101.68 112.27 24.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.329 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 129' ' ' ASN . 23.8 m-20 72.84 110.19 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.119 0.887 . . . . 0.0 111.392 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.402 ' HB2' ' HA2' ' A' ' 141' ' ' GLY . . . -86.42 94.15 9.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.83 -179.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -159.73 111.08 2.0 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 51.5 m95 70.08 8.13 6.53 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.392 0.677 . . . . 0.0 111.322 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -125.61 -160.48 10.68 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.475 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 0.8 OUTLIER -89.89 -14.08 35.01 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 118.257 1.028 . . . . 0.0 109.768 177.425 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 69.22 17.52 72.21 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.21 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.466 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 90.11 9.33 65.69 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 121.048 -0.596 . . . . 0.0 113.514 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -160.98 -37.75 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 117.593 0.696 . . . . 0.0 112.716 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 147.78 -48.54 0.63 Allowed Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.716 -179.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -76.11 58.68 1.24 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.58 0.705 . . . . 0.0 110.403 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.402 ' HA2' ' HB2' ' A' ' 131' ' ' ALA . . . -125.51 15.23 7.18 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 174.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.472 ' C ' ' H ' ' A' ' 144' ' ' ARG . 55.4 mttm 68.99 55.92 0.42 Allowed 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.732 -0.734 . . . . 0.0 111.411 -174.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -68.91 4.9 1.29 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.544 0.688 . . . . 0.0 109.747 173.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.514 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 0.0 OUTLIER -52.89 -17.3 1.33 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.174 176.156 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 55.7 tp -58.56 -58.34 8.97 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 169.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.616 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -59.77 -30.7 69.8 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.831 175.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -67.07 -40.8 87.09 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 177.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 89.0 mt -67.87 -33.92 75.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.901 0.381 . . . . 0.0 110.228 176.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 8.2 mp -59.62 -41.65 90.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.839 172.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.616 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 53.7 mtt -61.55 -52.0 66.27 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 175.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -47.69 -54.27 12.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.332 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 56.7 tp -68.93 -39.98 79.28 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.211 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.429 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 59.8 ttp180 -58.3 -50.31 74.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.814 -177.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . 0.608 ' HG2' ' O ' ' A' ' 150' ' ' MET . 14.7 mm-40 -59.98 -46.41 89.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.132 0.491 . . . . 0.0 110.177 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -59.53 -41.33 89.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.705 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.513 ' HB2' HD12 ' A' ' 116' ' ' LEU . 87.3 mt -77.17 -31.54 55.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.788 0.328 . . . . 0.0 110.846 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -64.27 -44.71 90.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.138 -179.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 154' ' ' GLU . 83.9 mt -57.25 -40.46 73.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.282 -179.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -80.14 -7.94 59.17 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.424 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -82.82 -26.93 31.25 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.27 -16.65 63.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.881 172.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.572 -178.773 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.4 t . . . . . 0 N--CA 1.45 -0.44 0 CA-C-O 121.32 0.581 . . . . 0.0 110.544 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.24 81.47 3.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.584 176.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.571 ' HA ' HD12 ' A' ' 114' ' ' LEU . . . -60.45 -56.1 25.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.56 -178.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 . . . . . 0 C--N 1.321 -0.636 0 CA-C-O 121.295 0.569 . . . . 0.0 110.943 -177.063 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.435 ' C ' ' H ' ' A' ' 12' ' ' MET . 2.1 m80 . . . . . 0 N--CA 1.452 -0.325 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.7 m -74.97 10.6 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.884 174.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.447 ' HB2' ' OG1' ' A' ' 15' ' ' THR . 57.3 mtm 69.09 -160.59 0.18 Allowed 'General case' 0 C--O 1.232 0.157 0 O-C-N 123.858 0.724 . . . . 0.0 109.9 -179.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -127.72 141.91 51.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -177.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 59.82 27.73 17.09 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.339 0.59 . . . . 0.0 110.713 -177.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.447 ' OG1' ' HB2' ' A' ' 12' ' ' MET . 96.8 m -92.7 124.09 36.46 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.168 -177.065 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mp -100.03 116.42 43.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.431 176.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 61.2 mt -89.86 96.73 6.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.416 0.627 . . . . 0.0 109.458 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -101.04 130.1 47.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.003 -177.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.0 p90 -132.1 177.33 7.65 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.091 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.51 103.99 5.02 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.419 177.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.1 m 63.02 -155.5 0.33 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.153 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.652 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 17.4 p -74.13 -16.0 61.02 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -177.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 m 47.67 -94.99 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 O-C-N 123.809 0.693 . . . . 0.0 111.34 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -162.46 115.27 1.69 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.581 174.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.1 t70 68.48 -68.95 0.16 Allowed 'General case' 0 N--CA 1.47 0.565 0 O-C-N 124.069 0.855 . . . . 0.0 112.321 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -78.37 -1.43 33.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.528 0.68 . . . . 0.0 111.087 -175.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.652 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -74.36 -0.24 56.91 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.361 175.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -46.27 -28.45 1.29 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.05 0.94 . . . . 0.0 112.955 -176.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -53.58 -38.69 64.16 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.583 0.23 . . . . 0.0 111.584 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 10.9 t -61.82 143.89 55.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.197 0.522 . . . . 0.0 110.819 -176.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -65.26 -31.57 72.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.001 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -77.51 9.99 2.92 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.303 0.573 . . . . 0.0 110.924 -176.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.78 142.56 46.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.661 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.55 62.23 4.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.592 0.71 . . . . 0.0 111.103 -175.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.437 ' CZ2' HD22 ' A' ' 111' ' ' LEU . 86.3 m95 -105.75 102.49 38.82 Favored Pre-proline 0 C--N 1.315 -0.895 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.041 173.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -56.91 131.0 42.83 Favored 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 122.903 2.402 . . . . 0.0 112.117 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.507 HG13 ' HB2' ' A' ' 44' ' ' TRP . 18.3 pt -122.32 126.33 74.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.501 0.667 . . . . 0.0 111.248 -178.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -88.17 103.24 15.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 175.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.43 125.32 65.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.826 -174.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 62.42 23.72 14.08 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.787 0.679 . . . . 0.0 111.209 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.61 13.25 76.23 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.31 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.634 ' HD2' ' HD3' ' A' ' 66' ' ' ARG . 71.7 mmtt -117.46 154.62 31.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 m -105.19 106.28 16.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.828 0.347 . . . . 0.0 110.462 179.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.507 ' HB2' HG13 ' A' ' 37' ' ' ILE . 32.8 m95 -105.13 121.46 46.35 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -59.11 -34.5 98.73 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.735 2.29 . . . . 0.0 112.768 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.8 p -146.4 165.38 29.52 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.85 -28.99 69.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.793 0.33 . . . . 0.0 111.438 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.652 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 7.6 mp0 -64.78 -28.55 69.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.632 -178.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -64.7 -47.06 79.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.471 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -70.87 -35.72 72.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.388 0.613 . . . . 0.0 109.608 177.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -58.51 -41.77 86.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.834 177.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.652 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 68.3 mm-40 -74.37 -46.65 39.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.414 178.029 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.93 -38.63 76.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.986 -176.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -84.14 -24.5 30.21 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.542 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.681 ' HZ2' ' HB2' ' A' ' 55' ' ' LYS . 4.1 ttmp? -60.01 -42.6 94.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.154 0.502 . . . . 0.0 110.242 172.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.432 ' HD1' ' O ' ' A' ' 52' ' ' GLN . 21.8 m-85 -77.37 135.07 38.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.327 178.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.639 ' H ' HD23 ' A' ' 57' ' ' LEU . 2.4 pt? -97.63 12.79 32.39 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.339 0.59 . . . . 0.0 109.484 175.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -98.5 128.52 44.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.91 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -69.94 -35.35 74.46 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -175.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -67.76 -36.92 81.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.849 0.357 . . . . 0.0 110.33 -178.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.409 ' O ' HG13 ' A' ' 65' ' ' ILE . 6.9 m-85 -77.79 -28.18 50.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.944 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 54.6 ttp85 -59.06 -51.8 68.49 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.036 0.446 . . . . 0.0 110.208 175.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -75.57 -19.38 59.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -69.12 -46.31 67.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.211 0.529 . . . . 0.0 110.184 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.581 HG22 ' HB2' ' A' ' 52' ' ' GLN . 68.7 mt -72.95 -19.63 18.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.396 0.617 . . . . 0.0 110.12 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.634 ' HD3' ' HD2' ' A' ' 42' ' ' LYS . 12.6 ttp180 -72.72 -28.17 62.5 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.324 170.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -78.36 -41.97 31.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.253 -176.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.481 HG21 ' HB ' ' A' ' 73' ' ' VAL . 8.4 p -65.28 121.38 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.562 0.696 . . . . 0.0 111.672 -175.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.8 m -77.32 -42.28 37.36 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.422 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.4 t -70.59 127.42 91.98 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.239 -176.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -66.61 -30.69 42.25 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.799 2.333 . . . . 0.0 111.924 176.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.2 mmt -70.19 -37.88 75.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.134 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.481 ' HB ' HG21 ' A' ' 68' ' ' VAL . 47.4 t -71.99 -32.22 43.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.091 0.472 . . . . 0.0 110.078 177.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.09 -39.84 93.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.22 173.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.88 -34.72 79.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.05 175.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -61.5 -33.15 73.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.122 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 25.6 mmt -61.77 -50.84 70.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.563 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.14 -26.05 62.74 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.833 -178.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 79' ' ' ARG . 2.6 tpt180 -84.47 -0.22 52.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.932 0.396 . . . . 0.0 110.326 -178.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.02 -31.45 71.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.022 -177.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 75.6 -46.24 0.56 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.95 175.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.5 m -82.59 40.17 0.65 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.306 0.574 . . . . 0.0 111.189 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -123.24 151.67 62.65 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.139 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.35 105.17 1.68 Allowed 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.286 1.991 . . . . 0.0 112.909 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.414 HD22 ' HD3' ' A' ' 55' ' ' LYS . 54.2 mt -86.8 145.32 26.66 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 174.146 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.563 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . 8.0 ptp180 -74.17 164.53 26.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.245 0.545 . . . . 0.0 111.934 -175.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tptt -67.68 -40.75 84.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.708 -172.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.4 ' O ' HG21 ' A' ' 92' ' ' VAL . 10.3 m120 -101.34 23.48 10.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.429 -172.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.402 ' CZ2' ' HE3' ' A' ' 55' ' ' LYS . 38.7 t-105 -58.69 -47.1 85.68 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -175.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -59.35 -29.21 67.5 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -175.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.4 p -90.29 -22.6 21.5 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -176.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.4 HG21 ' O ' ' A' ' 88' ' ' ASN . 31.1 m -108.24 -5.92 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -176.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.584 ' HZ3' ' HB3' ' A' ' 93' ' ' LYS . 8.1 ttpm? -49.11 -53.64 19.75 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.095 0.474 . . . . 0.0 111.614 -178.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -71.02 -29.98 66.05 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.52 -178.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -71.35 -42.39 68.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.934 -178.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 79.6 t -60.41 -46.62 94.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.104 0.478 . . . . 0.0 110.218 176.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.426 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 52.6 ttm -64.85 -42.21 95.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.756 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -65.8 -33.5 76.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.731 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.42 -45.12 77.05 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.03 0.443 . . . . 0.0 110.154 175.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.45 98.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.607 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 97' ' ' MET . 95.0 mt -66.04 -32.59 74.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.85 177.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.502 ' HG2' HD13 ' A' ' 152' ' ' LEU . 1.9 tmm_? -64.88 -44.26 90.22 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -69.06 -32.66 72.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.031 0.443 . . . . 0.0 110.669 176.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -63.71 -47.98 78.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.106 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.412 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 56.8 m-85 -85.6 -43.3 13.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -69.36 -43.71 73.02 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.538 -174.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 27.6 mt-30 -80.1 -1.36 39.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.899 0.38 . . . . 0.0 111.44 -175.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -122.95 96.42 5.01 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 170.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -53.74 -38.19 64.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.945 -171.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -57.74 -45.8 85.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 178.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.437 HD22 ' CZ2' ' A' ' 35' ' ' TRP . 34.6 mt -68.72 -42.45 77.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.249 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.585 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 49.4 ttp85 -59.53 -45.21 92.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.551 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.57 -42.49 98.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.709 178.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.571 HD12 ' HA ' ' A' ' 5' ' ' ALA . 50.3 tp -61.71 -48.87 78.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.619 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 47.8 tp -56.93 -43.56 81.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.906 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.83 HD23 ' HG2' ' A' ' 153' ' ' ARG . 47.9 mt -68.7 -35.04 76.67 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.168 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.15 -15.1 60.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -176.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 33.7 p -82.06 -21.42 36.88 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 120.199 -0.601 . . . . 0.0 111.913 -176.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.514 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -64.01 148.18 95.5 Favored Pre-proline 0 C--O 1.234 0.247 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.492 174.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -94.5 32.67 10.68 Favored 'Cis proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.906 -1.289 . . . . 0.0 113.544 1.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.31 140.91 48.81 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 176.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -85.79 119.93 26.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.539 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 40.6 mt -80.15 122.78 27.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.499 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 80.4 t -132.48 114.67 23.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.189 0.519 . . . . 0.0 112.123 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -77.99 115.77 17.98 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 167.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.545 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 59.9 t60 -87.8 77.23 8.62 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.739 -173.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.596 ' OG1' ' HA3' ' A' ' 134' ' ' GLY . 1.0 OUTLIER -77.33 96.75 4.69 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.779 -179.588 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -93.86 -16.03 24.47 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.796 -175.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -66.97 -43.92 81.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.493 176.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -163.25 152.96 15.32 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -178.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.19 85.64 5.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.405 0.621 . . . . 0.0 110.044 178.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.49 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 37.5 t80 -149.32 106.21 3.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.566 -176.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.596 ' H ' ' HB3' ' A' ' 142' ' ' LYS . 66.9 m95 65.74 10.06 6.49 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.652 -176.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.596 ' HA3' ' OG1' ' A' ' 127' ' ' THR . . . -131.26 -161.12 10.12 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.57 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.545 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 4.0 p-10 -91.42 -6.58 52.57 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.754 0.311 . . . . 0.0 111.301 -176.009 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 76.35 7.11 84.83 Favored Glycine 0 N--CA 1.454 -0.155 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.037 177.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.434 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 82.04 40.05 10.87 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.938 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -179.35 -25.91 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.343 0.257 . . . . 0.0 111.6 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . 0.436 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 132.37 -16.31 4.9 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 119.881 -1.152 . . . . 0.0 113.776 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -133.39 82.11 1.97 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 117.315 0.558 . . . . 0.0 110.459 -177.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.39 -60.91 0.19 Allowed Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.246 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.596 ' HB3' ' H ' ' A' ' 133' ' ' TRP . 1.7 ttmp? -175.48 48.87 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -65.76 5.11 0.5 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.003 -0.998 . . . . 0.0 112.735 -171.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 30.8 ttm180 -54.84 -22.45 14.58 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 133' ' ' TRP . 66.5 tp -61.48 -59.03 5.87 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.715 0.293 . . . . 0.0 110.345 174.458 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.404 ' HA2' HD12 ' A' ' 149' ' ' LEU . . . -61.95 -31.58 79.02 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.567 176.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . 0.402 ' HB3' ' HA ' ' A' ' 144' ' ' ARG . 56.8 t80 -61.68 -43.91 97.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.529 -0.336 . . . . 0.0 110.137 176.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 94.0 mt -66.9 -36.37 82.14 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.76 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.404 HD12 ' HA2' ' A' ' 146' ' ' GLY . 97.5 mt -60.76 -44.65 96.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.554 177.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 73.2 mtm -74.26 -34.59 63.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.875 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.04 -49.63 77.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.486 0.66 . . . . 0.0 109.619 175.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.502 HD13 ' HG2' ' A' ' 102' ' ' ARG . 55.5 tp -65.5 -34.63 78.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.076 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.83 ' HG2' HD23 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -59.12 -40.09 84.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.449 -179.362 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . 0.453 ' O ' HG13 ' A' ' 158' ' ' ILE . 13.7 mm-40 -64.71 -39.04 92.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.501 177.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -64.5 -43.67 93.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.088 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.503 ' HB2' HD22 ' A' ' 116' ' ' LEU . 89.1 mt -69.84 -31.13 68.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.888 0.375 . . . . 0.0 110.496 -177.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.88 -36.29 81.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.353 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 154' ' ' GLU . 97.4 mt -68.3 -42.72 84.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.62 178.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.71 -37.8 85.44 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.023 177.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -64.4 -35.54 81.25 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 7.2 tp -64.53 -29.52 70.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.379 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.78 -179.273 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 51.4 t . . . . . 0 N--CA 1.452 -0.362 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -87.76 81.63 7.56 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.564 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.25 34.86 0.57 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.527 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.882 -177.223 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.1 m -85.98 159.01 3.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.979 0.419 . . . . 0.0 110.317 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.1 mtm -93.14 18.75 8.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.929 -176.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 65.78 115.8 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.311 -178.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.8 t70 52.48 66.54 1.19 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.608 0.718 . . . . 0.0 110.802 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -117.15 150.52 38.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.687 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.479 HG13 ' HD2' ' A' ' 122' ' ' LYS . 3.5 mp -98.73 107.58 20.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 120.973 0.416 . . . . 0.0 110.089 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.2 mt -90.78 111.05 23.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.946 0.403 . . . . 0.0 110.711 -178.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.465 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 0.9 OUTLIER -90.79 104.44 17.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.774 176.744 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -100.76 137.28 39.35 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.774 0.321 . . . . 0.0 110.458 -178.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.422 ' O ' ' HB3' ' A' ' 21' ' ' SER . 5.1 t80 -150.54 169.9 20.42 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.876 175.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.425 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 39.9 t 75.64 109.28 0.07 Allowed 'General case' 0 C--O 1.231 0.099 0 O-C-N 123.924 0.765 . . . . 0.0 111.721 175.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 p -81.17 2.54 27.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.388 176.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -91.57 -4.68 55.1 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.223 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -107.88 165.87 11.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.722 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -77.1 -15.11 59.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.923 -175.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -101.22 -1.55 33.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.916 0.389 . . . . 0.0 111.07 176.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.425 ' HA3' ' O ' ' A' ' 21' ' ' SER . . . -75.74 0.16 62.22 Favored Glycine 0 C--O 1.229 -0.214 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.906 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.489 ' CG ' ' HZ1' ' A' ' 104' ' ' LYS . 18.9 t70 -57.51 -32.95 67.54 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -63.14 -21.35 66.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.596 -177.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 75.7 m -68.05 144.26 55.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.254 0.549 . . . . 0.0 111.052 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -67.78 -20.2 65.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.86 -176.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -95.06 10.89 34.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.941 0.401 . . . . 0.0 110.9 -177.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.43 140.17 58.09 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.85 0.357 . . . . 0.0 111.286 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.501 ' HA ' HG21 ' A' ' 46' ' ' THR . . . -86.08 59.43 5.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.94 -177.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.408 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 50.3 m95 -118.9 116.09 34.55 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.729 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 28.4 Cg_exo -61.59 128.16 23.84 Favored 'Trans proline' 0 C--O 1.238 0.52 0 C-N-CA 123.098 2.532 . . . . 0.0 112.413 -178.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.51 HG21 ' HA ' ' A' ' 104' ' ' LYS . 16.4 pt -112.31 133.7 57.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.891 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -93.95 105.07 17.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.693 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.2 t -123.88 118.94 55.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.996 -175.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 58.62 27.86 16.34 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.631 0.582 . . . . 0.0 111.428 176.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.44 -7.96 66.38 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.131 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -114.67 135.68 53.89 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 122.209 -0.583 . . . . 0.0 110.802 -177.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.5 m -95.4 106.44 18.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.92 -175.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 65.6 m95 -91.38 128.83 45.41 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.795 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.44 -35.55 85.28 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.087 2.524 . . . . 0.0 113.412 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.501 HG21 ' HA ' ' A' ' 34' ' ' ALA . 65.4 p -148.84 165.25 32.06 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 9.3 m -56.83 -41.56 78.09 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.285 0.366 . . . . 0.0 110.703 177.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.771 ' O ' ' HB2' ' A' ' 52' ' ' GLN . 10.0 tp10 -73.65 -1.13 17.68 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.735 -177.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.462 ' HE2' HG12 ' A' ' 68' ' ' VAL . 18.1 m80 -85.03 -40.61 16.65 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 120.984 -1.073 . . . . 0.0 109.47 171.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -74.16 -35.97 64.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.274 0.559 . . . . 0.0 109.573 174.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.518 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 37.8 t80 -72.03 -31.29 66.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.495 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.771 ' HB2' ' O ' ' A' ' 48' ' ' GLU . 3.8 tp-100 -71.73 -45.74 60.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.297 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.92 -37.31 84.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.146 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -88.42 -8.23 55.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.348 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.701 ' HZ1' ' HB2' ' A' ' 55' ' ' LYS . 4.9 ttmp? -69.46 -30.48 68.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.329 0.585 . . . . 0.0 109.936 175.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.475 ' CE2' ' HA2' ' A' ' 78' ' ' GLY . 91.3 m-85 -116.4 175.88 5.36 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.291 -178.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.28 7.23 9.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.792 178.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.747 ' HB2' ' HB2' ' A' ' 61' ' ' TYR . 27.9 m-20 -76.0 126.45 31.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.823 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -36.52 84.26 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.49 175.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 64' ' ' GLU . 35.9 mmtm -65.18 -48.29 73.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.567 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.747 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -63.02 -45.75 90.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.154 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -54.74 -42.79 72.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.66 178.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 27.5 mt-10 -69.48 -40.64 76.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.355 178.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 6.0 mm-40 -63.77 -44.44 93.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.832 0.348 . . . . 0.0 111.319 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.658 HG21 ' HB3' ' A' ' 52' ' ' GLN . 74.7 mt -67.27 -26.13 35.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.358 0.599 . . . . 0.0 110.675 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.15 -14.99 59.7 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.92 174.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 84.8 mtp180 -96.15 -4.64 42.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.378 -178.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.462 HG12 ' HE2' ' A' ' 49' ' ' HIS . 10.0 p -110.35 132.54 58.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.047 0.451 . . . . 0.0 111.651 -174.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -93.66 -36.83 12.15 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.415 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 2.5 m -63.13 117.17 30.63 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.993 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 21.8 Cg_exo -65.36 -42.06 14.13 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.854 2.369 . . . . 0.0 112.79 -176.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.4 tpt -65.0 -36.15 83.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.098 -175.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 98.4 t -63.97 -44.01 97.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-O 120.928 0.394 . . . . 0.0 110.357 178.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.84 98.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.484 178.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.4 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -61.53 -41.64 97.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.05 178.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.64 -48.3 82.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.282 -179.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.6 ptp -71.61 -22.77 61.67 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.821 -178.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.475 ' HA2' ' CE2' ' A' ' 56' ' ' PHE . . . -77.88 -20.19 73.91 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.634 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.3 mtp85 -86.47 38.73 0.8 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.034 0.445 . . . . 0.0 111.396 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -111.05 109.6 19.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.5 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' A' ' 81' ' ' ARG . 7.2 tpt180 -90.92 0.79 57.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.499 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.9 m -66.74 -37.84 85.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.035 -176.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.435 ' HD2' ' CE1' ' A' ' 56' ' ' PHE . 9.3 ptpp? -85.26 155.04 60.36 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.796 -178.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.63 117.74 5.26 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.329 2.019 . . . . 0.0 112.123 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.12 174.88 7.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.062 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.651 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 63.1 mtp180 -71.09 143.03 50.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.611 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -47.71 -44.6 27.79 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.174 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -118.01 27.03 9.25 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.474 -175.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.651 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 29.5 t-105 -58.69 -43.4 89.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.97 -15.86 60.22 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.11 -178.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 8.0 m -98.73 -48.89 4.78 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.903 0.382 . . . . 0.0 111.191 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.436 ' O ' HG23 ' A' ' 96' ' ' VAL . 33.4 m -76.69 -8.69 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.478 -176.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.456 ' HG2' ' HZ2' ' A' ' 133' ' ' TRP . 35.9 ttmt -48.63 -53.98 16.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.743 -179.105 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -69.88 -23.42 63.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.224 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -76.27 -42.92 43.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.962 0.411 . . . . 0.0 110.24 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 92' ' ' VAL . 87.7 t -60.56 -49.84 82.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.029 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 48.6 ttm -69.4 -33.19 72.64 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.991 -178.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 98' ' ' ARG . 14.2 ttm-85 -62.39 -41.65 98.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.769 0.319 . . . . 0.0 110.167 178.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -68.09 -39.31 82.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.617 178.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.64 -46.46 89.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.571 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.405 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 96.3 mt -63.9 -39.34 93.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.721 177.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 21.5 ttt180 -58.62 -46.99 85.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.04 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.73 -33.16 73.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.884 178.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.51 ' HA ' HG21 ' A' ' 37' ' ' ILE . 61.2 tttp -56.28 -59.35 5.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.268 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.528 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 89.3 m-85 -82.49 -9.69 59.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.167 -176.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -87.95 -35.4 17.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.958 0.408 . . . . 0.0 110.721 177.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -77.17 -47.68 19.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.384 -177.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -92.88 108.44 20.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.705 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.16 -29.76 70.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.122 176.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.94 -48.2 76.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.88 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 47.9 mt -74.51 -36.62 63.21 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.433 -176.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.528 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 25.5 ttm180 -59.53 -45.09 92.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.633 176.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.82 -39.41 94.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.587 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 tp -66.17 -44.36 84.27 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.551 177.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.417 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 53.6 tp -60.39 -51.94 67.35 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.302 179.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 157' ' ' ALA . 11.0 mp -67.09 -23.09 65.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.595 -177.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -68.43 -22.6 64.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.596 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 44.9 p -71.08 -35.96 72.07 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 116.73 -0.213 . . . . 0.0 111.078 -178.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -49.31 135.86 16.44 Favored Pre-proline 0 N--CA 1.464 0.249 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.47 -179.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.5 Cg_endo -99.55 48.31 1.99 Allowed 'Cis proline' 0 CA--C 1.536 0.604 0 C-N-CA 124.184 -1.173 . . . . 0.0 113.495 0.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -88.5 160.32 17.55 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.811 0.338 . . . . 0.0 111.497 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.479 ' HD2' HG13 ' A' ' 16' ' ' ILE . 46.4 mttp -86.18 146.34 26.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.939 178.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.8 mt -108.53 112.71 25.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.144 177.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.465 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 98.6 t -128.97 124.5 61.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.875 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -86.84 117.34 25.51 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.411 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 7.1 t60 -98.24 80.1 2.63 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.427 -170.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.2 t -103.15 162.19 13.17 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 171.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -138.92 15.24 2.67 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.818 0.818 . . . . 0.0 109.81 177.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -81.77 -26.23 34.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.124 173.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -173.95 -174.15 0.9 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.607 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.44 ' HB2' ' HA3' ' A' ' 141' ' ' GLY . . . -135.32 85.6 2.18 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 175.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.517 ' C ' ' H ' ' A' ' 134' ' ' GLY . 13.1 t80 -149.13 116.45 6.11 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.456 ' HZ2' ' HG2' ' A' ' 93' ' ' LYS . 83.3 m95 74.04 -35.69 0.31 Allowed 'General case' 0 N--CA 1.477 0.919 0 O-C-N 123.908 0.755 . . . . 0.0 109.783 -169.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.517 ' H ' ' C ' ' A' ' 132' ' ' TYR . . . -117.63 -172.94 16.12 Favored Glycine 0 N--CA 1.43 -1.706 0 N-CA-C 108.184 -1.966 . . . . 0.0 108.184 177.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.634 ' HB2' ' HB2' ' A' ' 143' ' ' ASN . 0.8 OUTLIER -111.88 168.52 9.52 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 118.935 -1.106 . . . . 0.0 111.615 -175.863 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -79.18 36.24 1.96 Allowed Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.498 ' H ' ' C ' ' A' ' 135' ' ' ASP . . . 88.26 -14.75 58.5 Favored Glycine 0 CA--C 1.523 0.547 0 CA-C-N 114.935 -0.632 . . . . 0.0 114.329 177.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . 0.453 ' CE1' ' HB3' ' A' ' 140' ' ' LYS . 9.9 p80 -111.89 -53.66 2.69 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 118.202 1.001 . . . . 0.0 113.601 -171.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 130.54 53.24 0.1 OUTLIER Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.346 -0.931 . . . . 0.0 112.479 -175.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.453 ' HB3' ' CE1' ' A' ' 138' ' ' HIS . 60.8 tttp -172.92 37.43 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.208 0.528 . . . . 0.0 110.155 -178.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.44 ' HA3' ' HB2' ' A' ' 131' ' ' ALA . . . -123.42 -65.28 0.21 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 120.095 -1.05 . . . . 0.0 113.217 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.534 ' C ' ' H ' ' A' ' 144' ' ' ARG . 48.4 tttp -173.2 25.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 117.255 0.527 . . . . 0.0 112.211 175.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.634 ' HB2' ' HB2' ' A' ' 135' ' ' ASP . 9.9 t30 -51.54 5.65 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.19 1.396 . . . . 0.0 114.166 173.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.534 ' H ' ' C ' ' A' ' 142' ' ' LYS . 9.9 tpt180 -45.57 -21.02 0.08 Allowed 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 22.9 tp -57.58 -45.76 84.83 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.891 0.377 . . . . 0.0 110.496 174.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -62.64 -31.46 80.04 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.701 -0.559 . . . . 0.0 111.701 178.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -66.8 -39.76 87.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 175.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 70.1 mt -63.61 -42.56 98.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.953 176.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 98.8 mt -60.71 -45.52 93.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.831 178.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.547 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 71.5 mtm -67.25 -39.05 86.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.96 178.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -61.86 -45.38 94.01 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.126 0.489 . . . . 0.0 110.306 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 67.6 tp -64.58 -39.11 93.15 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.658 177.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.417 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 59.8 ttp180 -56.59 -49.8 73.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.314 177.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 150' ' ' MET . 14.1 mm-40 -62.13 -36.27 81.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.603 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -62.23 -56.13 21.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.313 176.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.487 HD23 ' NH2' ' A' ' 112' ' ' ARG . 37.3 mt -68.89 -25.14 64.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.098 -173.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.508 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -62.68 -52.39 63.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.107 173.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 73.0 mt -73.0 -38.26 55.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.794 -179.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -57.33 -47.39 81.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.477 177.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . 0.411 ' HB3' ' HZ3' ' A' ' 160' ' ' LYS . 3.7 ttpm? -79.61 -14.4 58.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.101 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 18.5 tp -76.76 -20.52 56.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.169 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 . . . . . 0 CA--C 1.53 0.174 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.869 177.996 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.9 p . . . . . 0 CA--C 1.528 0.121 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.54 ' HB3' HE22 ' A' ' 6' ' ' GLN . 39.9 mtm105 62.41 83.53 0.15 Allowed 'General case' 0 C--N 1.342 0.254 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.141 -176.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.27 76.46 8.39 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.37 -176.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.54 HE22 ' HB3' ' A' ' 4' ' ' ARG . 2.3 mp0 . . . . . 0 C--N 1.323 -0.546 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.752 175.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 . . . . . 0 N--CA 1.464 0.243 0 CA-C-O 121.447 0.642 . . . . 0.0 111.72 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 m -84.75 16.18 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.991 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 43.3 mtm 66.77 -100.43 0.06 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.746 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 179.37 148.21 0.24 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 62.51 10.38 3.99 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 123.421 0.45 . . . . 0.0 111.603 177.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.1 m -83.35 114.36 21.37 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.302 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 51.6 mt -96.68 114.08 32.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.777 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.7 mt -93.21 109.97 22.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.433 -175.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.478 ' N ' HD21 ' A' ' 18' ' ' ASN . 0.9 OUTLIER -96.41 103.56 15.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.763 177.138 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -109.15 127.11 53.92 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.234 -176.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -150.55 100.59 2.87 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.66 170.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 m 161.89 101.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.209 1.404 . . . . 0.0 108.291 -177.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.506 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 10.2 p -79.46 -55.4 5.08 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.646 0.26 . . . . 0.0 111.376 -176.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m 56.65 -95.35 0.05 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.676 -176.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -178.2 21.03 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.094 0.473 . . . . 0.0 110.576 178.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.417 ' CG ' ' H ' ' A' ' 26' ' ' TYR . 14.9 p30 -136.97 -90.95 0.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -177.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.417 ' H ' ' CG ' ' A' ' 25' ' ' ASP . 28.5 t80 -86.41 -4.95 59.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.57 0.7 . . . . 0.0 110.182 -173.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.506 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -73.31 -0.02 50.65 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.223 -0.898 . . . . 0.0 112.945 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.533 ' CG ' ' HZ3' ' A' ' 104' ' ' LYS . 34.5 t70 -54.54 -23.57 17.16 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -176.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -64.88 -29.11 70.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.599 178.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.1 t -77.6 143.47 38.26 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -62.04 -30.91 71.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.934 0.397 . . . . 0.0 110.824 -174.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.487 ' HB3' HG22 ' A' ' 22' ' ' THR . 16.7 t80 -75.47 11.53 1.24 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.416 -173.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.442 ' CB ' ' HA ' ' A' ' 28' ' ' ASP . . . -73.83 106.0 5.36 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 175.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.547 ' HA ' ' HB ' ' A' ' 46' ' ' THR . . . -74.32 59.93 0.81 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.624 0.726 . . . . 0.0 112.522 -171.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 62.0 m95 -93.67 125.54 53.17 Favored Pre-proline 0 C--N 1.312 -1.06 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.742 172.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.55 125.37 17.17 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 122.678 2.252 . . . . 0.0 112.042 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.646 HG21 ' HA ' ' A' ' 104' ' ' LYS . 15.3 pt -114.99 141.87 30.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.872 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -100.05 100.1 10.93 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.415 HG13 ' OD2' ' A' ' 40' ' ' ASP . 4.5 t -124.04 127.08 73.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.11 -174.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.415 ' OD2' HG13 ' A' ' 39' ' ' VAL . 24.6 m-20 63.5 6.7 2.64 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.965 0.791 . . . . 0.0 111.913 176.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 114.02 -3.13 24.14 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.556 -0.83 . . . . 0.0 113.088 177.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -123.15 155.28 37.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.247 0.523 . . . . 0.0 111.065 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.6 m -94.73 119.98 34.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.448 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.479 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 37.9 m95 -109.13 124.21 34.69 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.445 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.566 ' O ' ' HB ' ' A' ' 46' ' ' THR . 4.8 Cg_exo -76.05 48.05 2.16 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.32 2.68 . . . . 0.0 113.683 -175.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.566 ' HB ' ' O ' ' A' ' 45' ' ' PRO . 1.6 t 129.57 160.69 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.5 1.52 . . . . 0.0 109.701 172.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 m -58.77 -38.78 79.25 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 123.563 0.539 . . . . 0.0 111.294 -177.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -53.11 -43.1 66.61 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.305 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 32.2 m80 -64.53 -39.52 93.92 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.328 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -76.1 -46.5 28.61 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.582 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -60.03 -50.03 75.34 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.578 -178.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.733 HE21 ' HA3' ' A' ' 78' ' ' GLY . 42.0 tp60 -64.63 -39.89 94.5 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.662 -177.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.838 ' HB2' ' HG3' ' A' ' 62' ' ' ARG . . . -68.71 -35.45 77.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.598 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -79.62 -16.84 55.1 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.909 0.385 . . . . 0.0 110.333 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.447 ' HE3' ' CD1' ' A' ' 89' ' ' TRP . 79.8 tttt -67.41 -21.8 65.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.793 -178.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.425 ' HZ ' ' CA ' ' A' ' 78' ' ' GLY . 82.2 m-85 -102.21 178.47 4.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.079 0.466 . . . . 0.0 111.901 -175.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.415 ' N ' HD13 ' A' ' 57' ' ' LEU . 5.6 mp -111.17 -37.01 5.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.642 -175.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.516 ' OD2' ' HB2' ' A' ' 61' ' ' TYR . 1.8 p-10 -75.5 111.65 11.02 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.602 0.715 . . . . 0.0 110.582 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -62.06 -32.85 73.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.658 -1.156 . . . . 0.0 111.791 -174.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.42 -37.9 76.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.105 0.479 . . . . 0.0 109.915 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.516 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . 2.0 t80 -77.06 -33.85 57.16 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.073 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.838 ' HG3' ' HB2' ' A' ' 53' ' ' ALA . 32.2 ttp85 -57.73 -44.84 86.3 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.372 0.606 . . . . 0.0 109.803 174.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -68.44 -31.57 70.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.233 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -70.14 -33.22 71.53 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.358 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.49 HD12 ' HA ' ' A' ' 53' ' ' ALA . 75.2 mt -72.65 -23.19 20.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.005 0.431 . . . . 0.0 110.772 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.454 ' HB2' ' CZ3' ' A' ' 44' ' ' TRP . 55.3 ttp85 -84.33 -20.67 31.66 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.286 0.565 . . . . 0.0 109.637 171.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -75.99 -30.55 58.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.143 -177.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.9 p -78.47 129.31 37.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.92 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 43.9 t -77.19 -37.58 53.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.583 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.431 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.9 m -77.18 119.55 77.95 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 -177.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 22.1 Cg_exo -65.2 -37.59 31.24 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.844 2.363 . . . . 0.0 112.401 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.4 tpt -65.35 -41.15 94.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.819 -176.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 94.5 t -60.22 -38.05 75.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.129 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.458 ' HB2' HG22 ' A' ' 65' ' ' ILE . . . -60.81 -58.51 8.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.015 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' ' 79' ' ' ARG . . . -60.98 -37.84 83.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.937 178.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.84 -49.92 73.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.73 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.456 ' HE1' ' HA ' ' A' ' 74' ' ' ALA . 27.1 ptt? -78.42 -19.28 53.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.867 0.365 . . . . 0.0 110.967 -176.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.733 ' HA3' HE21 ' A' ' 52' ' ' GLN . . . -93.85 0.03 66.82 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.41 176.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 33.1 ttt180 -89.95 -9.93 46.98 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -79.03 164.38 24.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.573 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -94.21 -5.99 45.71 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.275 -174.104 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.7 m -72.33 -8.04 52.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.171 0.51 . . . . 0.0 111.299 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -111.71 123.44 34.74 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.033 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.8 119.9 6.86 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.422 2.081 . . . . 0.0 111.185 173.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 59.2 mt -88.87 156.5 18.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.05 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.634 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 67.1 mtt180 -61.85 125.96 25.68 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 176.129 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -54.11 -44.13 71.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.933 -174.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -102.07 27.29 6.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.378 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.634 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 73.7 t-105 -58.15 -44.12 87.7 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.235 179.037 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -61.36 -21.95 64.5 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.591 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.9 m -80.55 -38.05 30.31 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.783 0.325 . . . . 0.0 110.874 177.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.4 m -97.32 1.91 10.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.087 0.47 . . . . 0.0 111.228 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -55.64 29.49 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.964 -178.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.82 -28.9 70.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.362 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -70.01 -51.35 32.99 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.795 0.331 . . . . 0.0 110.522 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 87.3 t -62.72 -39.3 84.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.4 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.792 ' HA ' ' HE3' ' A' ' 97' ' ' MET . 3.3 tpt -63.4 -43.21 98.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.203 178.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.629 ' HA ' HD13 ' A' ' 148' ' ' LEU . 56.7 ttp180 -61.8 -40.48 95.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.772 179.371 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -65.33 -50.53 65.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.765 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.82 -45.87 87.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.406 -177.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.748 ' HG ' ' HE1' ' A' ' 97' ' ' MET . 35.0 mt -65.17 -37.66 88.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.994 -176.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.636 ' HG3' HD21 ' A' ' 156' ' ' LEU . 31.2 ttp85 -67.67 -36.58 80.98 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.365 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.579 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -66.2 -31.77 72.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.117 0.484 . . . . 0.0 109.989 177.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.646 ' HA ' HG21 ' A' ' 37' ' ' ILE . 59.7 tttm -62.77 -49.35 75.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.886 179.115 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.469 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 81.8 m-85 -82.32 -33.32 29.0 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -176.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -75.26 -19.25 59.82 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 121.944 -0.472 . . . . 0.0 111.567 -179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.579 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.0 OUTLIER -86.38 -46.39 10.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.77 0.319 . . . . 0.0 110.242 177.329 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -99.39 100.22 11.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.463 ' HB2' HH21 ' A' ' 112' ' ' ARG . . . -62.29 -31.83 72.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.399 -173.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . 0.409 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.6 pm0 -68.87 -33.87 74.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.666 0.27 . . . . 0.0 110.661 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 57.9 mt -73.19 -35.99 66.48 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 176.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.469 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 28.0 ttp85 -58.17 -48.67 79.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.478 175.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.58 -40.03 93.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.593 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.6 tp -61.5 -43.45 98.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.633 178.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 39.5 tp -62.04 -56.42 19.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.629 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.3 mp -66.88 -16.55 64.38 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.991 -0.284 . . . . 0.0 111.5 -176.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -75.96 -13.2 60.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 60.7 p -89.23 -16.44 31.24 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 120.39 -0.524 . . . . 0.0 111.441 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.508 ' HB3' ' HD2' ' A' ' 153' ' ' ARG . . . -55.7 139.41 68.92 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.722 176.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -101.26 39.14 4.8 Favored 'Cis proline' 0 CA--C 1.535 0.548 0 C-N-CA 124.295 -1.127 . . . . 0.0 113.492 -1.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.04 153.56 42.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 0.0 111.151 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.512 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 56.3 tttp -86.98 122.98 31.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.035 -178.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 42.9 mt -91.2 125.13 35.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.527 -177.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 87.9 t -138.54 138.09 42.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.241 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -107.26 141.98 37.74 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -105.25 77.58 1.31 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.52 0.676 . . . . 0.0 109.612 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.69 86.36 5.3 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.731 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -78.02 -23.72 48.12 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.001 -174.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -83.69 -22.36 32.08 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -175.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -154.69 148.34 25.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.866 0.365 . . . . 0.0 110.824 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.517 ' HB2' ' HA2' ' A' ' 141' ' ' GLY . . . -106.56 87.43 2.53 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.621 -177.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.502 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 3.7 t80 -147.55 -37.75 0.2 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.852 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.558 ' HB3' HD23 ' A' ' 145' ' ' LEU . 7.1 m95 -134.45 32.55 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -176.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -162.21 -128.35 0.94 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 119.66 -1.257 . . . . 0.0 112.374 -177.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.31 -7.98 16.52 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.335 0.588 . . . . 0.0 109.688 174.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 70.69 6.06 58.16 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.539 178.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 83.58 11.4 80.0 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.303 -0.475 . . . . 0.0 112.467 -176.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -164.06 28.22 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.689 0.244 . . . . 0.0 111.14 -177.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 81.18 -51.31 4.34 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.558 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -80.7 58.32 3.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.174 0.511 . . . . 0.0 110.823 -175.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.517 ' HA2' ' HB2' ' A' ' 131' ' ' ALA . . . -123.3 15.26 8.18 Favored Glycine 0 C--N 1.318 -0.461 0 CA-C-N 115.754 -0.657 . . . . 0.0 113.85 -178.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.502 ' HD2' ' HA ' ' A' ' 132' ' ' TYR . 50.3 mttm 69.12 78.47 0.21 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.253 0.549 . . . . 0.0 111.375 178.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -70.06 5.31 1.67 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.335 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.427 ' H ' ' C ' ' A' ' 142' ' ' LYS . 0.0 OUTLIER -59.16 -18.62 37.76 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -177.247 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.558 HD23 ' HB3' ' A' ' 133' ' ' TRP . 43.1 tp -65.79 -53.0 46.12 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 118.239 0.472 . . . . 0.0 109.993 175.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -58.92 -39.56 94.22 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 177.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -64.69 -44.87 88.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.714 -0.243 . . . . 0.0 110.659 177.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.629 HD13 ' HA ' ' A' ' 98' ' ' ARG . 1.7 tm? -60.44 -45.94 91.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 90.5 mt -56.37 -43.46 79.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.157 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.512 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 73.8 mtm -72.46 -43.47 63.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.13 -179.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -66.73 -39.5 87.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.988 0.423 . . . . 0.0 110.457 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' A' ' 102' ' ' ARG . 55.0 tp -66.47 -37.65 85.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.849 176.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.63 HH11 ' HG2' ' A' ' 153' ' ' ARG . 23.3 ttp85 -61.23 -36.11 79.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.397 176.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 150' ' ' MET . 49.7 mm-40 -58.64 -49.18 78.45 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.035 0.445 . . . . 0.0 110.229 174.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -62.68 -46.01 90.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.831 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.636 HD21 ' HG3' ' A' ' 102' ' ' ARG . 97.8 mt -64.22 -32.96 74.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.752 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.35 -61.32 1.84 Allowed 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.09 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 69.6 mt -58.0 -38.47 67.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -170.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -64.23 -33.36 75.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.024 0.44 . . . . 0.0 111.228 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -94.03 -20.16 20.2 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.574 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 26.0 tp -72.63 -32.95 66.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.68 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 . . . . . 0 C--O 1.234 0.266 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.554 173.291 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.662 HG21 ' HB2' ' A' ' 25' ' ' ASP . 3.4 p . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 55.1 mtt85 -119.87 -36.85 3.2 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.114 -0.235 . . . . 0.0 111.235 -172.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.486 ' HB2' HD13 ' A' ' 114' ' ' LEU . . . 65.63 14.49 9.54 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.811 0.694 . . . . 0.0 110.472 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 . . . . . 0 C--N 1.331 -0.22 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.833 -175.117 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.3 t60 . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.4 m -87.52 -175.14 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.113 -177.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.489 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 10.1 mtt -97.7 -85.41 0.36 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.587 -174.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.489 ' H ' ' HB2' ' A' ' 12' ' ' MET . 3.2 pt20 -177.97 114.68 0.08 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.873 179.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.9 t70 57.9 31.53 20.7 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.812 0.815 . . . . 0.0 110.289 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.5 m -76.33 146.4 38.85 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.766 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.2 mt -109.01 108.69 25.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.222 0.534 . . . . 0.0 110.516 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.4 mt -89.91 101.81 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.158 -175.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -97.45 101.15 12.62 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.123 172.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -101.19 154.06 19.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.823 -176.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -150.17 164.32 35.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.1 p 54.09 100.61 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.632 0.773 . . . . 0.0 111.843 -177.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -69.02 2.99 2.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.62 -175.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.0 p -56.41 -36.72 69.25 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -176.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -92.69 165.52 12.92 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.287 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.662 ' HB2' HG21 ' A' ' 3' ' ' VAL . 6.0 p-10 -82.57 2.17 34.45 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -171.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -101.16 -4.4 27.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.187 0.518 . . . . 0.0 109.851 174.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -93.34 -0.23 67.77 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.682 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.451 ' CG ' HD21 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -58.0 -21.67 45.97 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -173.044 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.463 ' CZ ' ' HG ' ' A' ' 114' ' ' LEU . 97.1 m-85 -55.33 -21.73 16.25 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -177.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.513 ' HA ' ' OE2' ' A' ' 125' ' ' GLU . 22.8 t -62.42 141.68 58.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.097 0.475 . . . . 0.0 110.477 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -73.34 -21.38 60.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.751 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -90.81 6.08 45.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.176 0.512 . . . . 0.0 110.29 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.15 137.22 57.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.02 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.445 ' HA ' HG21 ' A' ' 46' ' ' THR . . . -84.7 59.69 5.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.294 0.568 . . . . 0.0 111.136 -176.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.55 ' HB2' ' HE2' ' A' ' 104' ' ' LYS . 81.4 m95 -112.18 113.36 51.75 Favored Pre-proline 0 C--N 1.318 -0.796 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.882 176.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.58 125.65 19.73 Favored 'Trans proline' 0 C--O 1.237 0.475 0 C-N-CA 123.289 2.659 . . . . 0.0 112.785 -176.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.651 HG23 ' HA ' ' A' ' 104' ' ' LYS . 26.9 pt -115.95 146.44 20.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.681 179.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -109.72 103.32 12.13 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.4 t -122.77 124.06 69.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.705 -175.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 59.62 24.93 13.77 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 123.805 0.691 . . . . 0.0 111.085 178.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.27 -4.02 82.46 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.881 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -104.44 138.56 40.65 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 122.363 -0.492 . . . . 0.0 110.805 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.9 m -90.74 114.31 26.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.454 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.448 ' HB2' HG13 ' A' ' 37' ' ' ILE . 51.3 m95 -108.58 130.62 22.53 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.82 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -65.95 -28.83 49.82 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.614 2.209 . . . . 0.0 112.467 -178.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.445 HG21 ' HA ' ' A' ' 34' ' ' ALA . 19.6 p -147.7 162.71 38.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.983 -177.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.1 m -66.85 -30.25 70.37 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.037 0.446 . . . . 0.0 110.616 178.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.411 ' OE1' ' HB3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -64.11 -28.99 70.15 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.611 -177.048 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.618 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 28.2 m80 -66.87 -41.81 86.68 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.971 -0.292 . . . . 0.0 110.845 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -70.9 -37.97 73.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.394 0.616 . . . . 0.0 109.511 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.467 ' HA ' HG11 ' A' ' 96' ' ' VAL . 78.3 t80 -61.35 -40.14 93.17 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.489 176.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.519 ' NE2' ' HA ' ' A' ' 75' ' ' ALA . 4.3 tp60 -72.28 -45.32 60.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.652 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.892 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -65.69 -38.91 90.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.168 -177.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.37 -16.94 44.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.582 0.215 . . . . 0.0 111.582 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.854 ' HZ3' ' HB2' ' A' ' 55' ' ' LYS . 4.8 ttmp? -57.2 -38.39 73.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.156 0.503 . . . . 0.0 110.526 173.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -98.93 149.08 23.32 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.337 -178.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.734 ' H ' HD22 ' A' ' 57' ' ' LEU . 2.3 pt? -95.71 1.95 53.71 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.244 0.545 . . . . 0.0 110.065 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -87.79 111.08 20.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.137 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.422 ' OE2' ' HD2' ' A' ' 62' ' ' ARG . 6.9 tp10 -60.43 -33.47 72.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.958 -177.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -62.71 -51.83 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.879 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.436 ' O ' ' HB3' ' A' ' 64' ' ' GLU . 0.5 OUTLIER -66.93 -29.8 69.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.018 0.437 . . . . 0.0 110.418 179.724 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.892 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.4 ttm180 -65.28 -41.32 94.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.122 175.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -62.96 -35.89 81.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.717 175.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.436 ' HB3' ' O ' ' A' ' 61' ' ' TYR . 11.4 tp10 -60.9 -55.43 33.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.905 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.536 ' O ' HG11 ' A' ' 68' ' ' VAL . 1.8 mp -61.98 -25.95 38.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 120.901 0.382 . . . . 0.0 111.309 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -71.87 -35.78 69.89 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 121.784 -0.572 . . . . 0.0 111.353 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -86.37 -0.03 55.04 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.702 -173.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.536 HG11 ' O ' ' A' ' 65' ' ' ILE . 11.9 p -95.59 117.54 39.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.32 0.581 . . . . 0.0 110.02 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.8 m -81.95 -24.97 35.25 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.991 0.424 . . . . 0.0 110.455 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.4 m -77.22 116.45 57.63 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.307 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.618 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 31.5 Cg_exo -59.85 -55.02 1.88 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.192 2.595 . . . . 0.0 113.064 -175.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 18.2 ttt -65.58 -22.84 66.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.498 -172.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 95.7 t -72.59 -37.79 57.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.838 0.351 . . . . 0.0 110.259 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.68 -45.81 92.74 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.051 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.519 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -62.2 -42.58 99.42 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.532 176.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -60.06 -55.91 28.08 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.579 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -74.78 -19.29 60.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.836 0.351 . . . . 0.0 111.121 -177.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.4 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -93.82 0.18 67.04 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.81 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 46.5 ttt180 -79.47 -0.61 33.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.196 0.522 . . . . 0.0 109.831 175.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -75.96 127.79 33.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.912 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.7 ttt180 -98.29 7.8 45.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.693 -175.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.2 m -83.01 -15.45 51.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.23 0.538 . . . . 0.0 110.344 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -79.32 150.24 73.63 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.147 179.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.412 ' HB2' HD21 ' A' ' 57' ' ' LEU . 18.3 Cg_endo -58.23 110.41 0.64 Allowed 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.657 2.238 . . . . 0.0 112.333 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.2 mt -85.99 120.77 27.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.829 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -68.63 134.0 49.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.257 0.551 . . . . 0.0 110.292 -178.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.51 -28.46 64.97 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.447 -170.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -90.88 16.88 8.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.561 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.475 ' CZ3' ' HA ' ' A' ' 55' ' ' LYS . 53.7 t-105 -58.98 -33.37 70.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.301 0.572 . . . . 0.0 109.871 174.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -56.63 -42.13 78.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.255 175.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 m -81.01 -43.34 19.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.69 -175.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.438 HG22 ' HA ' ' A' ' 89' ' ' TRP . 29.6 m -87.45 -3.46 9.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -170.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.477 ' HG3' ' N ' ' A' ' 94' ' ' GLU . 6.3 ptpp? -57.36 -36.88 71.78 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.839 0.352 . . . . 0.0 110.764 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.477 ' N ' ' HG3' ' A' ' 93' ' ' LYS . 7.6 pt-20 -78.41 -33.53 48.65 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.135 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -63.1 -43.77 97.57 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 -178.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.467 HG11 ' HA ' ' A' ' 51' ' ' PHE . 54.4 t -64.16 -49.17 82.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.382 176.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 10.1 mmt -61.45 -54.13 47.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.865 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -64.34 -27.09 68.79 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.789 -0.187 . . . . 0.0 111.314 -175.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -77.41 -46.38 22.85 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 176.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.64 -42.06 98.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.738 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.431 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 91.5 mt -64.88 -37.42 87.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.705 178.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.48 ' HA ' HD21 ' A' ' 152' ' ' LEU . 21.5 ttm-85 -63.46 -45.03 92.7 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 177.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.505 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -63.49 -38.37 90.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.781 0.324 . . . . 0.0 110.311 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.651 ' HA ' HG23 ' A' ' 37' ' ' ILE . 15.0 tptp -54.11 -56.3 19.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.499 176.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -80.64 -46.48 15.56 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -175.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.516 ' OE2' HD22 ' A' ' 156' ' ' LEU . 18.2 mm-40 -65.61 -21.56 66.59 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -175.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.505 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.8 tp-100 -79.29 -44.48 21.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.096 0.474 . . . . 0.0 110.506 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.421 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 64.5 m-70 -99.54 112.23 24.47 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.924 -176.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -59.39 -32.16 69.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.844 0.354 . . . . 0.0 110.352 178.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -58.01 -60.1 4.24 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.034 177.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.451 HD21 ' CG ' ' A' ' 28' ' ' ASP . 13.0 mt -69.44 -34.47 74.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.497 -175.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 108' ' ' HIS . 18.8 ttt180 -54.86 -54.67 39.41 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.137 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.13 -36.73 80.16 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.565 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' A' ' 5' ' ' ALA . 42.9 tp -58.09 -48.5 79.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.803 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.438 HD22 HD12 ' A' ' 156' ' ' LEU . 49.2 tp -58.61 -48.78 79.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.26 178.239 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.484 HD21 ' HB2' ' A' ' 156' ' ' LEU . 33.5 mt -70.16 -18.4 63.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.764 0.316 . . . . 0.0 111.339 -175.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -80.74 -14.82 57.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.682 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 72.9 p -73.74 -31.62 63.45 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.297 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -57.71 136.37 82.82 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.993 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -100.44 72.13 0.16 OUTLIER 'Cis proline' 0 N--CA 1.455 -0.768 0 C-N-CA 124.267 -1.139 . . . . 0.0 113.529 -0.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -110.98 157.59 19.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.842 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.434 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 0.3 OUTLIER -83.58 140.96 31.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.172 176.04 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.469 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 67.7 mt -109.02 114.83 28.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.304 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 42.3 t -129.09 115.9 38.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.153 -177.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.513 ' OE2' ' HA ' ' A' ' 30' ' ' SER . 40.2 tt0 -80.73 133.63 35.7 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 172.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 45.1 t60 -121.75 119.47 31.8 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.194 -175.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 13.0 t -121.9 166.45 14.39 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 170.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.465 ' HA ' ' HA3' ' A' ' 137' ' ' GLY . 3.9 mp0 -116.34 4.93 13.48 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.946 173.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -124.63 110.97 15.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.524 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 25.7 t70 74.47 112.75 0.07 Allowed 'General case' 0 N--CA 1.465 0.291 0 O-C-N 124.563 1.164 . . . . 0.0 111.867 176.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.52 ' HB2' ' HA2' ' A' ' 141' ' ' GLY . . . -86.39 112.79 21.79 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.964 178.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -155.21 -68.49 0.12 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.452 -176.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.551 ' HB3' HD23 ' A' ' 145' ' ' LEU . 92.1 m95 -110.34 58.18 0.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.414 0.626 . . . . 0.0 109.504 177.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 131.31 156.73 8.57 Favored Glycine 0 N--CA 1.442 -0.95 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 -171.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.968 ' HA ' ' HA3' ' A' ' 141' ' ' GLY . 14.2 t0 -54.75 137.34 44.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.769 0.284 . . . . 0.0 111.715 -174.032 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . 0.421 ' HA3' ' HB1' ' A' ' 131' ' ' ALA . . . -88.01 31.18 4.79 Favored Glycine 0 C--N 1.333 0.367 0 O-C-N 123.58 0.55 . . . . 0.0 111.988 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.465 ' HA3' ' HA ' ' A' ' 128' ' ' GLU . . . 78.98 54.48 4.12 Favored Glycine 0 C--N 1.317 -0.486 0 CA-C-N 114.838 -0.681 . . . . 0.0 114.076 177.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . 0.478 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 4.7 p80 -174.79 -37.11 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 135.09 25.36 0.54 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 120.194 -1.003 . . . . 0.0 112.654 -175.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.478 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 96.9 mttt -156.68 91.01 1.19 Allowed 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.968 ' HA3' ' HA ' ' A' ' 135' ' ' ASP . . . -142.16 1.18 1.65 Allowed Glycine 0 C--N 1.312 -0.776 0 C-N-CA 119.614 -1.279 . . . . 0.0 114.604 -178.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.444 ' C ' ' H ' ' A' ' 144' ' ' ARG . 24.5 mtmm 65.29 88.96 0.1 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.634 0.73 . . . . 0.0 110.37 -176.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -67.56 5.21 0.84 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.378 178.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.592 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 5.9 mmt180 -54.09 -24.74 18.62 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.551 HD23 ' HB3' ' A' ' 133' ' ' TRP . 52.1 tp -65.89 -52.96 45.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.106 0.479 . . . . 0.0 109.893 175.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.469 ' HA3' ' O ' ' A' ' 123' ' ' LEU . . . -66.21 -28.3 73.59 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.658 176.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -64.71 -37.74 88.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 91.9 mt -69.8 -35.91 75.23 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.374 175.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.456 HD13 ' HA2' ' A' ' 146' ' ' GLY . 95.7 mt -61.59 -44.68 96.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.185 176.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.543 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 74.3 mtm -72.74 -30.95 64.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.782 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -62.32 -54.2 44.04 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.48 HD21 ' HA ' ' A' ' 102' ' ' ARG . 56.6 tp -61.25 -39.3 89.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.847 178.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -53.0 -55.32 24.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.045 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 150' ' ' MET . 11.4 mm-40 -62.36 -39.19 92.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.222 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.762 HE21 ' HA ' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -61.18 -45.66 93.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.507 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.679 ' O ' ' HG2' ' A' ' 160' ' ' LYS . 87.2 mt -64.55 -44.78 89.68 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.458 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.18 -51.47 68.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.165 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 154' ' ' GLU . 82.1 mt -55.78 -40.98 64.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 O-C-N 123.072 0.232 . . . . 0.0 110.632 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.2 -47.9 84.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.686 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . 0.679 ' HG2' ' O ' ' A' ' 156' ' ' LEU . 46.6 mmtm -67.13 -35.23 79.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.739 -177.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.48 -23.23 65.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.513 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 . . . . . 0 C--N 1.324 -0.508 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -175.918 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 121.095 0.474 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 72.9 mtm180 -115.66 11.36 15.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.556 -176.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.22 -25.29 65.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.45 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.582 -177.668 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 p-80 . . . . . 0 CA--C 1.52 -0.183 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 31.7 m -104.36 176.66 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 120.661 0.267 . . . . 0.0 110.675 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.452 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 0.2 OUTLIER -99.93 -96.68 0.25 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.801 -174.164 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.452 ' H ' ' HB2' ' A' ' 12' ' ' MET . 24.2 mm-40 -146.65 116.27 7.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.286 -177.038 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 48.11 36.84 7.03 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 123.708 0.63 . . . . 0.0 111.917 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.2 m -76.32 125.08 28.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.805 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.658 HG13 ' HD3' ' A' ' 122' ' ' LYS . 2.2 mp -85.49 116.77 29.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 174.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.0 mt -96.71 98.43 7.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.956 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.519 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 45.4 m-80 -86.74 101.48 13.34 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 177.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.478 ' O ' ' HA ' ' A' ' 125' ' ' GLU . 49.7 p90 -103.8 146.48 28.56 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 177.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -150.34 141.58 23.2 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.503 -177.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 96.0 p 60.18 119.72 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.656 1.222 . . . . 0.0 112.358 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.761 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 0.6 OUTLIER -55.44 -64.66 0.77 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.931 178.61 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.3 m 45.87 -95.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.848 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -160.74 34.47 0.15 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 122.059 0.933 . . . . 0.0 108.556 -177.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -126.35 -145.29 0.32 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.167 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.18 -1.42 15.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.424 178.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.761 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -60.64 -0.15 1.24 Allowed Glycine 0 CA--C 1.525 0.697 0 CA-C-N 115.787 -0.642 . . . . 0.0 114.524 -178.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -55.12 -25.48 31.98 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.011 0.905 . . . . 0.0 111.073 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -65.51 -36.95 85.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.763 174.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.0 m -57.32 145.69 31.38 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.511 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -81.22 10.85 4.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.868 -175.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -105.48 6.27 32.25 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.49 0.662 . . . . 0.0 109.481 175.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.526 ' HA ' HG22 ' A' ' 22' ' ' THR . . . -71.43 141.92 50.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.635 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.62 52.53 1.91 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.101 0.477 . . . . 0.0 111.616 -176.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -108.26 106.65 59.04 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.957 177.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -56.48 139.57 87.54 Favored 'Trans proline' 0 C--O 1.238 0.522 0 C-N-CA 123.064 2.509 . . . . 0.0 112.547 -178.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.507 HG21 ' HA ' ' A' ' 104' ' ' LYS . 24.7 pt -119.98 131.66 71.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.746 -178.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -96.62 93.56 6.82 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 44.5 t -102.66 123.61 56.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.85 -176.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 58.99 24.29 12.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.329 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 97.09 3.88 58.82 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.711 176.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.466 ' HD3' ' HA ' ' A' ' 42' ' ' LYS . 25.0 mmtp -128.01 152.12 48.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.133 0.966 . . . . 0.0 111.822 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.0 m -91.63 113.83 26.2 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.557 -171.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.496 ' HB2' HG13 ' A' ' 37' ' ' ILE . 63.4 m95 -101.29 128.53 29.06 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 172.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.55 -39.02 90.25 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.933 2.422 . . . . 0.0 112.521 -176.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.82 171.28 17.97 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.066 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.8 m -69.86 -43.33 72.11 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -172.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.615 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -62.5 -31.7 72.5 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -175.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.452 ' NE2' HG12 ' A' ' 68' ' ' VAL . 19.7 m80 -55.06 -41.85 71.99 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.447 ' CE2' HG13 ' A' ' 96' ' ' VAL . 55.2 t80 -73.07 -40.63 64.89 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.276 178.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.469 ' HA ' HG12 ' A' ' 96' ' ' VAL . 54.2 t80 -61.92 -51.74 66.91 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.977 -179.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.615 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 11.3 mm100 -62.35 -40.09 95.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.946 -177.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.463 ' HB3' ' HB2' ' A' ' 62' ' ' ARG . . . -66.95 -27.6 67.6 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.155 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -84.38 -19.83 32.94 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.542 -177.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -64.28 -52.62 57.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.981 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.556 ' HE1' ' HG3' ' A' ' 83' ' ' LYS . 84.9 m-85 -69.85 153.1 43.76 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -169.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.432 HD11 ' N ' ' A' ' 57' ' ' LEU . 6.0 mp -97.94 -1.45 42.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.883 173.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.642 ' HB2' ' HB2' ' A' ' 61' ' ' TYR . 5.8 m-20 -86.8 110.78 20.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.524 176.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -60.56 -36.46 78.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.116 0.484 . . . . 0.0 109.882 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -62.36 -41.38 98.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.7 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.642 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 1.8 m-85 -64.81 -44.8 88.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.319 -0.4 . . . . 0.0 112.006 -175.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.463 ' HB2' ' HB3' ' A' ' 53' ' ' ALA . 5.1 ptp85 -66.75 -31.16 71.63 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.951 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -70.15 -35.88 74.36 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 174.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -64.7 -40.73 95.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.866 176.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.524 ' HA ' HG13 ' A' ' 68' ' ' VAL . 72.5 mt -71.88 -20.65 20.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.212 0.53 . . . . 0.0 110.525 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -77.7 -10.13 59.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.108 0.48 . . . . 0.0 110.44 173.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -110.75 -28.53 8.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.294 -178.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.524 HG13 ' HA ' ' A' ' 65' ' ' ILE . 13.5 p -62.64 121.38 11.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.53 0.681 . . . . 0.0 111.315 -176.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.1 m -85.09 -12.68 52.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.159 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.1 t -102.23 124.04 41.12 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.056 -177.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.96 -34.45 59.41 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.897 2.398 . . . . 0.0 111.99 177.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 85.2 mmm -66.41 -37.47 85.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.179 -177.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 94.9 t -68.1 -41.23 84.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.539 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.26 91.63 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.37 177.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.451 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -59.61 -42.28 92.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.859 176.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -60.8 -45.11 95.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.021 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 66.8 mtt -57.47 -51.1 70.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.303 0.573 . . . . 0.0 110.728 178.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.497 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -73.23 -14.25 79.21 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.783 -177.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -73.32 -31.34 63.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.68 0.276 . . . . 0.0 110.534 -178.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -64.92 138.01 58.11 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.044 0.45 . . . . 0.0 111.384 -177.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.54 4.64 28.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.639 -177.04 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.1 m -83.44 -31.98 26.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 0.0 110.06 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.556 ' HG3' ' HE1' ' A' ' 56' ' ' PHE . 32.2 mmmt -65.14 146.88 98.86 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.862 177.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.57 148.07 88.97 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.929 2.42 . . . . 0.0 112.598 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 98.2 mt -112.39 159.72 18.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.33 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.684 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 54.4 mtp180 -83.29 153.24 24.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.374 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.13 -34.06 75.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.883 0.373 . . . . 0.0 110.627 179.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.425 ' O ' HG21 ' A' ' 92' ' ' VAL . 10.5 p30 -100.87 12.95 36.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.31 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.684 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 55.0 t-105 -65.81 -17.56 64.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.145 0.498 . . . . 0.0 109.758 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.408 ' OE2' ' HA ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -65.26 -39.48 92.68 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.341 176.673 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.0 p -99.17 -42.49 7.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.454 ' O ' HG23 ' A' ' 96' ' ' VAL . 32.6 m -67.96 -14.03 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -167.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.629 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 35.2 mtmm -51.87 -44.25 63.63 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.096 0.474 . . . . 0.0 111.131 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -80.46 -25.36 38.93 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.624 -175.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.413 ' OE1' ' HA ' ' A' ' 92' ' ' VAL . 1.7 mp0 -70.87 -40.68 72.14 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 174.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.469 HG12 ' HA ' ' A' ' 51' ' ' PHE . 84.3 t -63.96 -48.75 84.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.772 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.3 ttm -70.43 -30.67 67.59 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.303 -178.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.1 ttm-85 -63.9 -38.0 89.46 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -65.22 -42.82 93.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.627 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.91 -48.28 81.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.786 178.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.2 mt -62.46 -46.7 87.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.074 178.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.484 ' HA ' HD21 ' A' ' 152' ' ' LEU . 49.8 ttt85 -59.14 -51.98 67.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.555 -178.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -62.78 -29.85 71.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 0.0 111.151 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.507 ' HA ' HG21 ' A' ' 37' ' ' ILE . 88.3 tttt -64.2 -53.65 45.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.821 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.519 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 86.2 m-85 -77.69 -22.95 49.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.88 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 44.3 mt-10 -72.34 -49.88 30.96 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.128 -0.358 . . . . 0.0 110.917 175.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.2 OUTLIER -71.68 -26.03 62.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.893 -175.918 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -116.52 101.93 9.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.908 0.385 . . . . 0.0 110.111 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.13 75.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.816 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . 0.442 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.4 pm0 -69.41 -30.52 68.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.805 0.336 . . . . 0.0 110.621 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 29.2 mt -74.59 -37.51 62.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.747 ' HG3' HD13 ' A' ' 156' ' ' LEU . 16.5 ttm180 -64.17 -44.29 92.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.924 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.93 -43.91 97.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.375 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.1 tp -57.68 -48.42 79.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.809 176.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.41 HD23 HD11 ' A' ' 156' ' ' LEU . 43.4 tp -57.65 -44.83 85.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.845 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.464 HD23 ' HB2' ' A' ' 156' ' ' LEU . 78.8 mt -69.5 -29.52 67.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.539 -178.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -70.31 -17.34 63.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.705 -178.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 47.5 p -72.61 -35.63 67.89 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.745 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -50.92 133.44 29.2 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.824 -179.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -100.55 38.65 5.21 Favored 'Cis proline' 0 CA--C 1.535 0.574 0 C-N-CA 124.184 -1.173 . . . . 0.0 113.432 1.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -75.1 157.96 33.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.288 0.566 . . . . 0.0 111.099 178.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.658 ' HD3' HG13 ' A' ' 16' ' ' ILE . 86.7 tttt -95.39 122.8 38.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.264 -173.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.3 mt -90.27 119.27 30.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.787 0.327 . . . . 0.0 111.216 -175.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 60.5 t -136.75 119.36 20.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.731 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 19' ' ' PHE . 37.7 tt0 -97.38 116.94 30.54 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 171.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.545 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 1.4 t-80 -87.1 77.11 9.18 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.354 -170.129 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 17.1 m -86.37 107.7 18.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.105 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.9 -28.5 11.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.61 -178.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -55.89 -42.44 75.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.52 177.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -140.42 136.18 32.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.432 -177.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -100.41 87.51 3.42 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.925 0.393 . . . . 0.0 110.844 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -146.55 -45.29 0.19 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.549 ' HB3' HD23 ' A' ' 145' ' ' LEU . 85.9 m95 -131.2 107.27 8.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.434 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 129.15 -149.77 18.65 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.031 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.545 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 3.8 m-20 -73.03 -28.83 62.57 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.97 0.414 . . . . 0.0 111.646 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 70.16 10.17 65.06 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 110.209 -1.156 . . . . 0.0 110.209 -168.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 92.29 -12.51 69.48 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 114.826 -0.687 . . . . 0.0 113.537 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -144.45 0.75 1.03 Allowed 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -174.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 111.28 -50.49 0.77 Allowed Glycine 0 CA--C 1.517 0.196 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.619 178.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -81.45 61.31 4.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.706 0.765 . . . . 0.0 109.955 178.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -132.13 15.21 5.08 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.777 176.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt 70.44 79.61 0.18 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.326 0.584 . . . . 0.0 111.865 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -77.72 5.42 9.4 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.755 0.788 . . . . 0.0 110.12 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.624 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 46.1 mtm105 -62.98 -8.19 6.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.878 -177.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.549 HD23 ' HB3' ' A' ' 133' ' ' TRP . 66.5 tp -66.61 -49.09 67.44 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 168.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -59.09 -37.89 92.28 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 173.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -63.75 -45.81 88.18 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.581 -0.31 . . . . 0.0 110.911 176.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 87.9 mt -56.77 -41.4 77.58 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.887 0.375 . . . . 0.0 110.399 178.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.96 -45.88 91.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.947 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.557 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 75.3 mtm -71.64 -36.57 70.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.235 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -62.81 -49.17 75.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.531 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.484 HD21 ' HA ' ' A' ' 102' ' ' ARG . 48.9 tp -66.16 -34.16 77.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.259 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.409 ' HB3' ' O ' ' A' ' 150' ' ' MET . 62.1 ttp180 -54.4 -48.81 71.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.693 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . 0.557 ' HG2' ' O ' ' A' ' 150' ' ' MET . 5.7 mm-40 -59.96 -39.71 86.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.504 -178.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -63.78 -39.87 95.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.537 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.747 HD13 ' HG3' ' A' ' 112' ' ' ARG . 87.8 mt -78.29 -15.09 59.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.958 -178.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -79.69 -45.57 18.74 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 174.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 154' ' ' GLU . 63.5 mt -60.66 -29.28 44.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.104 177.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . 0.441 ' HB3' ' O ' ' A' ' 156' ' ' LEU . 5.5 tt0 -47.9 -53.83 14.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.408 174.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -80.71 -10.83 59.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.621 -174.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 157' ' ' ALA . 8.2 mp -74.66 -22.01 59.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.022 0.439 . . . . 0.0 110.254 175.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.732 -179.986 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.3 t . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.597 0.237 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 44.4 mtm180 -115.44 97.2 6.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.314 -176.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.84 94.83 1.08 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 172.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.215 -174.234 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.2 t60 . . . . . 0 N--CA 1.453 -0.309 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.8 m -77.98 165.18 3.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.379 0.609 . . . . 0.0 111.291 176.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.733 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 13.8 mtt -95.39 50.42 1.24 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.047 -174.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 61.31 -94.88 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.886 -174.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -115.4 74.79 0.9 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.679 0.752 . . . . 0.0 109.317 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.733 ' HB ' ' HB2' ' A' ' 12' ' ' MET . 7.0 t -94.35 154.73 17.34 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.6 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.528 HG12 ' HB2' ' A' ' 122' ' ' LYS . 58.3 mt -111.1 123.6 67.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.029 0.443 . . . . 0.0 110.328 179.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.3 mt -101.7 105.57 18.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.107 -179.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.632 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 20.4 m120 -96.57 123.87 40.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.836 177.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -104.76 147.54 27.59 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.848 0.356 . . . . 0.0 110.863 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.603 ' HE1' ' O ' ' A' ' 126' ' ' HIS . 78.3 m-85 -126.99 114.29 17.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.652 -177.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.8 t 56.46 -150.18 0.44 Allowed 'General case' 0 CA--C 1.534 0.358 0 O-C-N 123.585 0.553 . . . . 0.0 109.702 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.499 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 26.0 p -89.45 -55.91 3.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 173.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.4 m 67.22 -69.68 0.13 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 174.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -129.9 179.75 5.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.181 -168.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -71.99 -27.4 62.73 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -73.38 -6.38 45.86 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.144 172.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.499 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -79.82 0.06 83.46 Favored Glycine 0 C--O 1.23 -0.129 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.653 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.51 ' CG ' ' HZ2' ' A' ' 104' ' ' LYS . 31.5 t70 -49.14 -21.11 0.68 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -59.29 -21.8 60.22 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.947 0.403 . . . . 0.0 111.07 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.2 t -82.11 129.53 34.84 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -78.41 5.16 11.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.865 0.364 . . . . 0.0 111.514 -178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -92.88 -3.17 55.07 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 175.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.16 136.66 52.45 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.925 176.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.68 60.82 4.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.42 0.629 . . . . 0.0 111.067 -174.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -104.02 120.88 49.68 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.591 175.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.449 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 30.8 Cg_endo -64.34 124.24 13.06 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.89 2.393 . . . . 0.0 112.523 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.615 HG21 ' HA ' ' A' ' 104' ' ' LYS . 25.9 pt -113.27 156.34 14.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.516 177.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -111.1 97.11 6.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.99 0.424 . . . . 0.0 110.258 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.524 HG13 ' HD3' ' A' ' 99' ' ' LYS . 87.8 t -119.04 122.85 70.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.23 -174.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 58.71 30.23 19.68 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 123.844 0.715 . . . . 0.0 110.839 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.5 14.82 75.26 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.754 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -126.16 143.13 51.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.894 0.347 . . . . 0.0 110.454 -179.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.3 m -91.5 115.74 28.29 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.348 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.492 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 72.9 m95 -105.23 133.18 20.28 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.926 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.492 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 8.9 Cg_exo -71.67 -11.26 27.76 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 123.071 2.514 . . . . 0.0 113.012 -177.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -165.6 146.6 7.06 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.7 m -57.59 -39.12 76.08 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.319 0.387 . . . . 0.0 111.107 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -61.19 -28.01 68.83 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.675 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.538 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 14.8 m80 -64.37 -44.74 90.41 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.847 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -74.19 -36.76 64.03 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.176 0.512 . . . . 0.0 110.005 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -61.61 -46.76 88.44 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.567 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.549 ' HB3' HD13 ' A' ' 65' ' ' ILE . 0.6 OUTLIER -71.72 -31.17 66.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.482 -178.941 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.97 -45.98 79.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.791 0.329 . . . . 0.0 111.001 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -77.2 -15.15 59.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.881 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.432 ' HB3' ' O ' ' A' ' 52' ' ' GLN . 87.1 tttt -63.22 -34.36 77.49 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.506 177.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -108.24 155.84 20.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.298 -178.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.599 ' H ' HD23 ' A' ' 57' ' ' LEU . 2.5 pt? -108.1 11.84 27.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.13 -177.12 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -95.91 120.38 36.09 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 177.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -57.72 -43.51 85.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.606 -173.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 64' ' ' GLU . 86.3 tttt -64.76 -56.88 10.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.728 -176.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.42 ' CZ ' ' HE2' ' A' ' 83' ' ' LYS . 7.1 t80 -60.61 -35.74 76.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.197 0.522 . . . . 0.0 110.14 -178.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.555 ' HE ' ' HG3' ' A' ' 63' ' ' GLU . 2.6 tmm_? -58.48 -46.25 87.04 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.493 176.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.555 ' HG3' ' HE ' ' A' ' 62' ' ' ARG . 35.4 mt-10 -83.51 -7.17 59.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.917 -177.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 19.0 mm-40 -74.67 -39.32 62.08 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 169.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.549 HD13 ' HB3' ' A' ' 52' ' ' GLN . 54.7 mt -70.6 -26.19 28.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.602 175.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.503 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . 25.7 tpt180 -72.53 -29.58 63.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.506 172.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 25.9 ttm-85 -80.65 -37.41 30.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.889 -175.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.489 HG23 ' HB ' ' A' ' 73' ' ' VAL . 11.1 p -71.41 120.39 19.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.443 0.64 . . . . 0.0 111.332 -176.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.0 t -80.42 -36.19 34.05 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.533 178.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.7 m -69.72 124.35 90.42 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.744 -178.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.538 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 35.4 Cg_endo -65.53 -45.45 6.89 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.866 2.377 . . . . 0.0 113.083 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 25.0 ttt -63.75 -26.05 68.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.586 -174.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.489 ' HB ' HG23 ' A' ' 68' ' ' VAL . 54.2 t -72.53 -36.67 54.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.96 0.41 . . . . 0.0 110.16 178.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.98 -44.35 89.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.88 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.579 ' O ' ' HG2' ' A' ' 79' ' ' ARG . . . -57.45 -48.92 77.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.679 173.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -51.89 -64.06 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.842 -178.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.512 ' HE1' HG12 ' A' ' 65' ' ' ILE . 27.1 ptt? -80.75 -4.88 56.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.134 0.493 . . . . 0.0 111.001 -175.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.52 -25.29 39.65 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 121.033 -0.604 . . . . 0.0 111.923 175.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 75' ' ' ALA . 58.6 mmt-85 -89.72 3.84 51.48 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 177.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.418 ' C ' ' H ' ' A' ' 82' ' ' SER . 14.1 t70 -59.47 -42.85 92.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.798 -177.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 71.25 -15.92 0.39 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.534 0.734 . . . . 0.0 112.341 173.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.418 ' H ' ' C ' ' A' ' 80' ' ' ASP . 13.1 m -90.27 23.61 2.84 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.219 0.533 . . . . 0.0 110.563 -177.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.42 ' HE2' ' CZ ' ' A' ' 61' ' ' TYR . 12.3 mmmt -109.44 162.47 20.07 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 177.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.42 114.47 2.14 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.173 1.915 . . . . 0.0 112.154 178.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 92.5 mt -84.89 154.26 22.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.045 -177.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -82.34 144.8 30.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.957 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -69.39 -51.97 31.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.118 0.485 . . . . 0.0 111.011 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -86.59 27.56 0.95 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.939 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.447 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 41.3 t-105 -62.15 -23.42 66.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.571 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.441 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 40.5 mm-40 -76.18 -18.63 59.0 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.016 178.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.1 m -99.8 -19.13 16.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.858 -177.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.426 ' HA ' ' HB3' ' A' ' 95' ' ' GLN . 28.3 m -111.06 2.11 8.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -168.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 59.4 mttp -60.05 -59.91 4.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.448 0.642 . . . . 0.0 110.424 -179.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.489 ' CD ' ' H ' ' A' ' 94' ' ' GLU . 1.4 pm0 -78.87 -17.19 56.01 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.04 -177.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.426 ' HB3' ' HA ' ' A' ' 92' ' ' VAL . 10.2 tt0 -77.75 -48.28 17.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.484 179.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.419 HG23 ' HB ' ' A' ' 92' ' ' VAL . 68.3 t -64.77 -40.85 90.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 120.963 0.411 . . . . 0.0 109.909 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.8 tpp -60.16 -39.08 85.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.483 177.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -63.59 -40.94 98.23 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.439 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.524 ' HD3' HG13 ' A' ' 39' ' ' VAL . 39.0 ttmt -63.48 -46.51 85.83 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 177.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.61 -43.58 98.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.643 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.676 ' HB3' HD23 ' A' ' 152' ' ' LEU . 35.4 mt -60.13 -49.63 76.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.464 178.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.56 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 32.1 ttt180 -64.84 -45.78 84.68 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.533 -178.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.44 -28.7 68.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.191 0.519 . . . . 0.0 110.786 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.615 ' HA ' HG21 ' A' ' 37' ' ' ILE . 53.9 tttm -70.24 -53.7 15.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.791 179.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -86.82 -0.03 55.69 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -177.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.842 ' HA ' HH21 ' A' ' 112' ' ' ARG . 1.8 mm-40 -92.08 -40.64 10.94 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.628 0.251 . . . . 0.0 110.846 172.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -71.26 -38.89 71.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.947 0.403 . . . . 0.0 110.758 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -109.33 110.19 21.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.155 -175.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.5 -24.03 63.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.176 176.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -58.71 -54.17 50.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.718 176.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 27.9 mt -69.59 -35.53 75.42 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.478 -176.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.842 HH21 ' HA ' ' A' ' 106' ' ' GLU . 42.5 ttm180 -57.37 -47.47 81.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.876 178.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.74 95.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.643 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.0 tp -61.29 -47.53 85.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.507 178.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.27 -45.67 92.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.026 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 156' ' ' LEU . 74.3 mt -68.43 -18.82 64.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.6 -177.395 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -77.9 -7.28 56.51 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 63.5 p -85.3 -32.73 22.36 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.514 -178.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.04 136.36 14.38 Favored Pre-proline 0 N--CA 1.467 0.42 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -100.4 35.54 7.16 Favored 'Cis proline' 0 C--N 1.349 0.567 0 C-N-CA 124.45 -1.063 . . . . 0.0 113.156 -1.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -66.26 149.5 50.26 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.652 0.263 . . . . 0.0 111.222 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.528 ' HB2' HG12 ' A' ' 16' ' ' ILE . 55.7 mttp -79.87 125.38 29.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.735 179.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 53.9 mt -90.62 100.97 13.72 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.632 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 98.8 t -133.45 126.86 52.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.962 -174.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.564 ' CD ' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -83.6 136.59 34.18 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 174.425 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.736 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 72.5 t60 -134.26 77.24 1.69 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.955 0.407 . . . . 0.0 110.051 172.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.564 HG21 ' CD ' ' A' ' 125' ' ' GLU . 8.9 t -112.97 130.46 56.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.292 0.568 . . . . 0.0 109.544 175.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.497 ' HG2' ' CA ' ' A' ' 137' ' ' GLY . 29.2 mt-10 -87.81 12.35 13.2 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.436 -175.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -91.24 -35.24 14.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.583 -178.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -152.44 135.6 15.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.78 0.324 . . . . 0.0 110.864 -177.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.455 ' CB ' ' HA3' ' A' ' 136' ' ' GLY . . . -110.58 91.72 3.77 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.298 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -153.75 -31.15 0.12 Allowed 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.115 -178.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -137.15 36.92 2.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.591 0.234 . . . . 0.0 111.54 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.498 ' HA3' ' CD ' ' A' ' 125' ' ' GLU . . . -174.08 -114.9 0.37 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.162 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.736 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 16.3 t70 -111.62 -33.73 6.27 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.895 0.379 . . . . 0.0 110.866 -176.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . 0.455 ' HA3' ' CB ' ' A' ' 131' ' ' ALA . . . 74.2 6.5 74.85 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.031 177.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.497 ' CA ' ' HG2' ' A' ' 128' ' ' GLU . . . 78.7 40.69 17.26 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.917 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -178.02 -22.68 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . 0.422 ' HA2' ' OD2' ' A' ' 135' ' ' ASP . . . 127.28 -44.11 1.27 Allowed Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.222 -0.989 . . . . 0.0 113.043 174.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -91.37 68.39 5.83 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.778 0.799 . . . . 0.0 109.163 -177.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.413 ' HA2' ' HB2' ' A' ' 131' ' ' ALA . . . -123.1 14.89 8.31 Favored Glycine 0 C--N 1.311 -0.838 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.842 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 75.8 mttt 61.74 69.77 0.62 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.28 0.562 . . . . 0.0 111.732 173.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.467 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 7.6 t30 -72.92 5.54 3.21 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.337 -174.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.582 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 77.8 mtm-85 -48.07 -24.21 1.03 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 50.7 tp -57.25 -56.05 26.77 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.656 0.265 . . . . 0.0 110.764 174.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.545 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -64.49 -30.43 77.85 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 121.282 -0.485 . . . . 0.0 111.895 178.008 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -64.58 -42.3 95.69 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 95.3 mt -61.5 -41.24 96.98 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.095 175.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.87 -38.77 89.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.025 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 63.9 mtt -60.46 -51.25 70.26 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.162 0.506 . . . . 0.0 110.217 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -64.6 -41.02 96.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.849 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.676 HD23 ' HB3' ' A' ' 101' ' ' LEU . 54.7 tp -62.34 -42.04 99.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 178.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -59.48 -56.27 24.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.539 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.6 -32.99 70.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.049 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -64.25 -40.03 95.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.789 177.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.495 ' HB2' HD22 ' A' ' 116' ' ' LEU . 96.0 mt -77.69 -22.98 49.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.985 0.421 . . . . 0.0 110.613 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.41 -50.37 26.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.045 174.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 80.7 mt -65.05 -26.25 39.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.402 178.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -52.76 -40.72 63.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.602 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -74.58 -30.62 61.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.827 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.7 mp -70.75 -33.54 70.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.215 0.531 . . . . 0.0 110.361 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 . . . . . 0 C--N 1.325 -0.496 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.176 174.143 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.234 0.27 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.804 ' HB2' ' HB3' ' A' ' 25' ' ' ASP . 21.6 ttt180 -128.04 50.5 2.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.107 0.48 . . . . 0.0 110.249 177.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.457 ' HA ' HD13 ' A' ' 114' ' ' LEU . . . -74.84 58.63 0.84 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.562 0.696 . . . . 0.0 110.063 174.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 . . . . . 0 C--N 1.324 -0.543 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.627 -177.668 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 35.7 t-80 . . . . . 0 N--CA 1.451 -0.379 0 CA-C-O 121.003 0.43 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.622 ' HB ' ' HG1' ' A' ' 15' ' ' THR . 33.3 m -99.74 170.56 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.49 ' HE1' HG22 ' A' ' 15' ' ' THR . 42.3 mtt -72.67 -74.53 0.16 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.618 0.723 . . . . 0.0 109.695 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -175.71 -56.45 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.955 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -125.59 72.59 1.28 Allowed 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.26 -1.337 . . . . 0.0 107.648 168.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.622 ' HG1' ' HB ' ' A' ' 11' ' ' VAL . 4.2 m -76.62 154.54 34.26 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.622 -170.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.9 mm -115.79 124.11 71.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 45.5 mm -106.9 101.72 12.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.029 178.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -100.48 104.43 15.82 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -118.01 137.98 52.51 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.45 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.57 ' CE1' ' HA ' ' A' ' 127' ' ' THR . 8.9 t80 -150.28 149.33 29.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.486 176.336 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.5 p 66.61 154.01 0.08 Allowed 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.669 1.188 . . . . 0.0 111.941 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.533 HG22 ' HA ' ' A' ' 33' ' ' ALA . 1.8 m -93.98 0.23 55.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.539 0.685 . . . . 0.0 109.841 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m -75.12 -32.15 61.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.397 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.83 161.03 24.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.468 177.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.804 ' HB3' ' HB2' ' A' ' 4' ' ' ARG . 2.8 m-20 -68.05 -24.68 65.1 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.637 -176.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -76.37 -1.36 26.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.788 175.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.452 ' O ' ' HB3' ' A' ' 30' ' ' SER . . . -65.98 -3.27 16.06 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.808 -0.633 . . . . 0.0 113.176 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -61.63 -30.29 70.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.122 0.461 . . . . 0.0 110.553 174.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -72.94 -23.82 60.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.852 177.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 27' ' ' GLY . 29.2 t -58.83 138.1 57.42 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.464 0.649 . . . . 0.0 111.48 -176.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -72.93 -17.09 61.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.705 177.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -90.51 -5.62 55.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.365 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.533 ' HA ' HG22 ' A' ' 22' ' ' THR . . . -64.0 146.86 53.36 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.832 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.38 59.22 3.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.268 0.556 . . . . 0.0 111.719 -174.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -109.99 109.7 59.05 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.993 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.53 139.08 68.41 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.703 2.268 . . . . 0.0 112.178 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.502 HG23 ' HA ' ' A' ' 104' ' ' LYS . 27.2 pt -124.86 138.31 54.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.018 0.437 . . . . 0.0 111.275 -177.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.553 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 50.0 tptt -97.66 106.59 18.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 t -126.44 126.84 69.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.45 -174.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 54.71 23.74 5.03 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 124.043 0.84 . . . . 0.0 112.141 173.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.04 -14.67 31.26 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.667 -0.777 . . . . 0.0 113.416 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -121.52 153.73 37.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.913 0.857 . . . . 0.0 111.322 -175.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 12.1 m -99.41 108.66 21.2 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.214 -176.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.46 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 48.3 m95 -97.99 135.18 21.54 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.607 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.576 ' O ' HG23 ' A' ' 46' ' ' THR . 11.4 Cg_exo -71.78 57.46 2.51 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.788 2.326 . . . . 0.0 112.412 176.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.576 HG23 ' O ' ' A' ' 45' ' ' PRO . 0.7 OUTLIER 92.98 170.11 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.672 1.589 . . . . 0.0 112.708 172.436 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 m -49.33 -47.82 46.93 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 114.33 -1.304 . . . . 0.0 112.517 -172.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -54.38 -33.53 59.38 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.917 0.389 . . . . 0.0 111.604 -175.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.4 ' CE1' ' HB2' ' A' ' 45' ' ' PRO . 44.7 m80 -75.66 -43.57 46.91 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 122.057 -0.402 . . . . 0.0 110.822 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.421 ' HA ' ' HB1' ' A' ' 53' ' ' ALA . 42.9 t80 -70.29 -26.28 63.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.952 0.406 . . . . 0.0 110.396 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.476 ' HA ' HG13 ' A' ' 96' ' ' VAL . 27.3 t80 -62.81 -52.87 61.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.512 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.729 ' HB3' HD12 ' A' ' 65' ' ' ILE . 2.4 mp0 -62.97 -34.39 77.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.594 174.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.659 ' HA ' ' HG2' ' A' ' 62' ' ' ARG . . . -65.72 -29.02 69.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.707 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.436 ' HA ' HE21 ' A' ' 54' ' ' GLN . 0.0 OUTLIER -105.41 2.92 29.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.124 0.487 . . . . 0.0 110.06 178.602 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -83.71 -57.94 3.01 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.214 174.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.563 ' CE1' ' HB2' ' A' ' 83' ' ' LYS . 57.0 m-85 -88.02 143.24 27.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.505 -179.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.685 ' H ' HD22 ' A' ' 57' ' ' LEU . 2.5 pt? -102.08 8.71 40.74 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.631 0.253 . . . . 0.0 111.657 -175.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -89.43 121.74 31.96 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.27 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -59.03 -44.86 91.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.443 -176.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -68.47 -52.73 29.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.508 -174.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -67.28 -30.74 70.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.857 0.36 . . . . 0.0 110.864 -178.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.659 ' HG2' ' HA ' ' A' ' 53' ' ' ALA . 5.3 tmm_? -68.67 -34.46 75.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.298 0.57 . . . . 0.0 109.5 177.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -67.18 -27.76 67.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.534 175.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 67' ' ' ARG . 1.3 tp10 -72.74 -28.61 62.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.231 176.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.729 HD12 ' HB3' ' A' ' 52' ' ' GLN . 37.9 mt -77.05 -22.24 14.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.276 0.56 . . . . 0.0 110.595 177.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -76.69 -19.74 57.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 170.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.416 ' HB3' ' O ' ' A' ' 64' ' ' GLU . 7.3 tpp180 -75.78 -43.53 46.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.605 -179.291 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.7 p -63.86 120.34 10.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.334 0.588 . . . . 0.0 110.423 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.2 m -86.0 -31.72 21.89 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.289 -177.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 35.5 t -72.32 123.37 89.41 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.77 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 17.0 Cg_exo -67.8 -34.41 24.35 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.74 2.293 . . . . 0.0 111.652 177.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.82 ' HE2' ' HA ' ' A' ' 72' ' ' MET . 2.2 tpt -67.48 -47.25 70.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.521 -178.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.8 t -65.3 -37.48 80.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.46 -47.55 83.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.83 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.541 ' O ' ' HG3' ' A' ' 79' ' ' ARG . . . -66.7 -41.13 88.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.443 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.3 tpt180 -55.3 -53.73 52.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.032 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.506 ' HE1' HG12 ' A' ' 65' ' ' ILE . 24.6 ptt? -80.2 -23.78 40.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.815 0.34 . . . . 0.0 110.775 -178.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.56 -8.24 85.91 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.955 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.541 ' HG3' ' O ' ' A' ' 75' ' ' ALA . 89.7 mtt180 -89.34 -6.83 56.34 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 122.392 -0.475 . . . . 0.0 110.921 175.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -71.87 125.26 26.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.011 0.434 . . . . 0.0 109.955 176.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.652 ' HG3' HD12 ' A' ' 85' ' ' LEU . 14.5 ttm180 -96.9 15.58 21.82 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.554 -174.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.1 m -91.74 -8.04 48.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.931 178.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.563 ' HB2' ' CE1' ' A' ' 56' ' ' PHE . 45.2 mmtm -88.77 162.32 38.99 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.422 176.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.516 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 51.5 Cg_endo -68.7 100.92 0.72 Allowed 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 121.883 1.722 . . . . 0.0 112.532 -178.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.652 HD12 ' HG3' ' A' ' 81' ' ' ARG . 97.1 mt -84.35 150.13 25.58 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.686 174.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -82.28 143.35 31.38 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 174.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -57.99 -31.43 66.92 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -169.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -104.6 21.99 15.81 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 121.031 -0.268 . . . . 0.0 111.296 -176.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.434 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 43.3 t-105 -58.43 -48.53 80.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.451 -177.117 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.947 ' HA ' ' HE3' ' A' ' 93' ' ' LYS . 1.0 OUTLIER -55.99 -23.38 32.3 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -177.164 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.0 p -99.91 -17.37 17.62 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.9 m -105.53 7.05 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.947 ' HE3' ' HA ' ' A' ' 90' ' ' GLU . 97.6 mttt -59.5 -41.9 90.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.086 0.47 . . . . 0.0 111.061 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.487 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 5.0 pt-20 -73.0 -24.33 60.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.161 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -72.3 -43.36 64.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.162 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.476 HG13 ' HA ' ' A' ' 51' ' ' PHE . 62.7 t -62.12 -38.64 81.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.197 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 21.8 mmt -59.62 -38.84 82.41 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.814 176.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 94' ' ' GLU . 81.7 mtt180 -59.05 -44.97 91.87 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.996 0.427 . . . . 0.0 110.773 177.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 tmtp? -66.72 -49.52 65.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.575 -178.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.26 68.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.72 -176.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.488 HD13 HD22 ' A' ' 149' ' ' LEU . 41.7 mt -64.58 -36.14 83.26 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -177.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.538 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 70.8 ttt180 -65.09 -53.62 42.7 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.784 177.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.44 -32.93 67.4 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.99 0.424 . . . . 0.0 110.82 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.502 ' HA ' HG23 ' A' ' 37' ' ' ILE . 58.7 tttp -54.51 -52.78 60.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.958 175.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -82.42 -30.92 29.85 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.602 ' HA ' ' NH2' ' A' ' 112' ' ' ARG . 28.6 mm-40 -63.46 -49.15 74.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.59 0.233 . . . . 0.0 111.604 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.553 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 79.6 mm-40 -74.47 -20.88 59.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -175.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -116.1 105.02 12.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.808 0.337 . . . . 0.0 111.17 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.54 -27.75 69.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.194 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -57.17 -51.27 70.0 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.69 175.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 67.2 mt -73.05 -39.18 66.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.958 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.602 ' NH2' ' HA ' ' A' ' 106' ' ' GLU . 35.1 ttm-85 -57.9 -44.73 86.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.856 0.36 . . . . 0.0 110.569 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.27 -41.26 94.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.806 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.457 HD13 ' HA ' ' A' ' 5' ' ' ALA . 57.8 tp -62.53 -41.83 99.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.54 178.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 62.0 tp -65.16 -40.25 94.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.892 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.455 HD21 ' HB2' ' A' ' 156' ' ' LEU . 43.3 mt -81.05 -6.41 58.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.772 0.32 . . . . 0.0 111.042 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.31 -31.99 22.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.069 177.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.9 p -72.9 -21.82 60.84 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.211 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.509 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -52.48 139.0 39.29 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.439 178.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . 0.501 ' HD2' HG21 ' A' ' 11' ' ' VAL . 41.2 Cg_endo -100.1 40.66 4.16 Favored 'Cis proline' 0 CA--C 1.534 0.519 0 C-N-CA 124.371 -1.095 . . . . 0.0 113.241 -0.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.51 ' CB ' ' HB ' ' A' ' 15' ' ' THR . . . -66.77 154.69 40.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.302 0.572 . . . . 0.0 112.108 -177.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.51 ' HZ1' ' HB2' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -82.31 119.21 23.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.61 179.484 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 23.3 mt -86.31 112.78 21.73 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.804 0.335 . . . . 0.0 110.67 -176.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.8 t -129.13 127.24 65.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.073 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -97.55 129.19 44.71 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -91.22 77.36 5.95 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.57 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -77.57 86.22 3.9 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.966 -177.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -76.62 -18.25 58.71 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.769 -175.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -90.53 -29.88 17.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.622 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . 0.43 ' O ' ' HB ' ' A' ' 127' ' ' THR . 8.9 t70 -145.51 138.87 26.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.816 -172.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.523 ' HB2' ' HA2' ' A' ' 141' ' ' GLY . . . -99.86 86.01 3.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 176.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -151.7 -34.87 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.954 -177.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.622 ' HB3' HD23 ' A' ' 145' ' ' LEU . 71.1 m95 -119.12 -0.23 11.12 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -172.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -155.39 -120.83 0.72 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 119.631 -1.271 . . . . 0.0 113.19 -172.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.513 ' HB2' ' HA2' ' A' ' 139' ' ' GLY . 1.2 p-10 -105.54 -10.21 17.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.957 0.408 . . . . 0.0 110.83 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 72.2 12.32 76.03 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.52 174.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 80.2 19.57 69.17 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.879 -178.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -163.42 19.21 0.07 Allowed 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . 0.513 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 79.86 -0.44 82.49 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 120.579 -0.82 . . . . 0.0 114.306 174.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -138.2 72.02 1.4 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.445 0.623 . . . . 0.0 110.121 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.523 ' HA2' ' HB2' ' A' ' 131' ' ' ALA . . . -129.07 15.15 5.88 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.558 -172.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.439 ' C ' ' H ' ' A' ' 144' ' ' ARG . 33.0 tttm 68.17 80.35 0.2 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.0 0.905 . . . . 0.0 110.523 179.197 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.38 5.33 1.81 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 114.363 -1.29 . . . . 0.0 110.906 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.649 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 24.5 ttt180 -48.09 -26.83 2.0 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.201 0.6 . . . . 0.0 112.576 -176.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.622 HD23 ' HB3' ' A' ' 133' ' ' TRP . 37.6 tp -64.22 -48.57 75.35 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.058 0.456 . . . . 0.0 110.108 178.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -64.76 -29.05 74.21 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.549 177.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -70.2 -38.8 75.4 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 176.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 89.5 mt -58.26 -49.82 75.77 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.249 0.547 . . . . 0.0 109.531 174.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.488 HD22 HD13 ' A' ' 101' ' ' LEU . 96.4 mt -65.21 -31.3 72.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.881 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.6 tpp -61.92 -53.04 61.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.085 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -69.26 -33.97 74.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.538 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.407 ' O ' ' HG2' ' A' ' 155' ' ' GLN . 61.7 tp -60.74 -46.14 91.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.058 0.456 . . . . 0.0 110.071 175.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.509 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 54.0 ttp85 -58.83 -49.54 77.32 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.029 177.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . 0.467 ' O ' HG13 ' A' ' 158' ' ' ILE . 44.4 mt-10 -71.66 -32.04 67.47 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -176.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 152' ' ' LEU . 9.3 pt20 -71.66 -32.19 67.64 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.427 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.455 ' HB2' HD21 ' A' ' 116' ' ' LEU . 84.5 mt -73.78 -25.81 60.32 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.45 ' O ' ' HB3' ' A' ' 160' ' ' LYS . . . -72.18 -43.64 64.24 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.055 173.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.494 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 87.2 mt -62.91 -42.91 98.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 175.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -58.14 -31.35 67.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.107 175.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . 0.967 ' HA ' ' HE3' ' A' ' 160' ' ' LYS . 0.4 OUTLIER -66.86 -40.28 87.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.929 177.26 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.32 -23.31 65.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.666 177.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 158' ' ' ILE . 22.7 mm-40 . . . . . 0 C--N 1.323 -0.577 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.167 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.5 t . . . . . 0 N--CA 1.452 -0.336 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 4' ' ' ARG . 24.8 ttp85 60.23 54.02 4.19 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.19 178.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.1 77.66 4.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.228 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.953 -179.852 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 . . . . . 0 N--CA 1.454 -0.244 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.0 m -59.46 146.7 9.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.277 0.56 . . . . 0.0 111.308 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.4 mtm -94.14 22.66 5.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.391 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 68.42 -70.05 0.14 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.549 -173.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -77.9 44.79 0.48 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.88 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.9 m -97.75 113.32 25.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.625 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.7 mt -111.41 105.75 19.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 176.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 71.3 mt -92.67 102.02 13.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.728 -173.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.584 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 6.2 p30 -103.19 133.94 47.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.674 177.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -140.39 141.54 35.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.035 -175.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.65 ' O ' ' HB2' ' A' ' 21' ' ' SER . 6.6 t80 -150.27 100.22 2.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.182 165.083 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.65 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 6.0 t 150.19 110.7 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 124.85 1.344 . . . . 0.0 108.013 179.186 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.684 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 2.9 m -74.43 -70.26 0.41 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.1 m 47.46 -92.57 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.805 0.842 . . . . 0.0 113.087 174.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -157.24 27.27 0.3 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.524 0.678 . . . . 0.0 109.246 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.412 ' HA ' ' NH2' ' A' ' 4' ' ' ARG . 3.6 t70 -117.94 -153.16 0.52 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.166 -173.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -66.84 -1.31 3.78 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.018 0.437 . . . . 0.0 111.165 177.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.684 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -65.48 -0.45 6.29 Favored Glycine 0 C--O 1.225 -0.44 0 CA-C-N 115.749 -0.66 . . . . 0.0 113.504 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -56.48 -26.87 55.53 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 117.296 0.548 . . . . 0.0 111.315 175.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -66.55 -24.91 66.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.625 177.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.4 m -69.41 128.97 38.44 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 174.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 -76.09 10.52 1.89 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -172.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -95.01 2.2 55.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.223 0.535 . . . . 0.0 109.65 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.24 129.76 41.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.872 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.431 ' HA ' HG21 ' A' ' 46' ' ' THR . . . -86.8 62.89 7.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.414 0.626 . . . . 0.0 111.037 -174.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -102.15 125.51 36.36 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.563 175.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -61.61 116.78 3.65 Favored 'Trans proline' 0 C--O 1.239 0.563 0 C-N-CA 122.377 2.051 . . . . 0.0 111.119 174.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.568 HG21 ' HA ' ' A' ' 104' ' ' LYS . 26.1 pt -116.94 132.77 65.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.963 -178.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.545 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 5.0 tppp? -91.76 103.85 16.36 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 177.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.7 t -121.31 115.21 45.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.676 -177.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 64.64 14.82 9.3 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.568 176.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 114.57 -12.56 20.96 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.114 177.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -110.43 143.86 40.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 117.282 0.541 . . . . 0.0 111.564 -177.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.7 m -92.72 103.62 15.97 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.189 178.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.41 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 66.4 m95 -91.18 134.29 30.18 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 5.1 Cg_exo -76.44 -1.36 11.42 Favored 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 123.05 2.5 . . . . 0.0 112.743 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.431 HG21 ' HA ' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -169.73 150.31 3.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.202 -178.704 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.9 m -58.1 -40.68 81.78 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.318 0.386 . . . . 0.0 110.426 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 14.4 tp10 -57.68 -31.32 66.23 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.511 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.4 ' NE2' HG12 ' A' ' 68' ' ' VAL . 10.2 m80 -64.96 -43.9 91.15 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 122.074 -0.391 . . . . 0.0 111.138 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -72.3 -35.28 68.62 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 177.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.566 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 1.7 t80 -60.3 -46.5 89.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.557 177.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.58 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 79.2 mm-40 -57.88 -46.19 85.25 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.444 175.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.95 -33.4 68.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.521 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.413 ' HB3' ' HZ3' ' A' ' 89' ' ' TRP . 1.6 tp-100 -92.13 -14.58 28.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.741 -178.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.566 ' HG3' ' O ' ' A' ' 51' ' ' PHE . 91.8 mttt -67.73 -38.52 83.65 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.044 0.45 . . . . 0.0 111.141 178.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -110.45 139.41 45.7 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.844 -174.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.76 HD21 ' H ' ' A' ' 57' ' ' LEU . 1.8 pt? -89.53 -7.87 53.99 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.626 -175.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -73.03 138.83 46.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.949 0.404 . . . . 0.0 110.714 -177.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -72.0 -39.48 69.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.781 -175.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -82.86 -36.03 25.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.793 0.33 . . . . 0.0 110.54 -174.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.517 ' O ' HG12 ' A' ' 65' ' ' ILE . 4.9 t80 -66.52 -37.66 85.51 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.138 178.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 38.4 ttp-105 -66.78 -37.62 84.93 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.662 0.744 . . . . 0.0 109.696 174.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 34.0 tt0 -63.27 -33.19 74.97 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.294 175.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.41 ' OE2' ' HD2' ' A' ' 67' ' ' ARG . 5.7 tp10 -69.25 -36.1 76.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.965 177.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.517 HG12 ' O ' ' A' ' 61' ' ' TYR . 50.3 mm -60.66 -34.11 57.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.391 176.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -65.36 -32.92 74.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.973 175.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.448 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 45.9 mtt180 -81.7 -33.2 31.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.789 -172.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.4 HG12 ' NE2' ' A' ' 49' ' ' HIS . 7.2 p -68.8 112.57 3.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.351 0.596 . . . . 0.0 111.482 -176.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.6 m -71.98 -40.38 68.63 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.01 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.416 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 19.4 m -81.45 132.95 54.07 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.719 -173.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 20.9 Cg_exo -67.03 -44.18 5.52 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 123.179 2.586 . . . . 0.0 112.943 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.3 tpt -67.63 -36.8 81.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.753 0.311 . . . . 0.0 110.947 -173.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 67.2 t -62.71 -43.15 98.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.304 178.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.28 -43.43 91.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.399 177.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.64 -39.9 95.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.891 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.471 ' C ' ' HD3' ' A' ' 76' ' ' ARG . 1.9 tmt_? -61.52 -53.88 50.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.711 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.419 ' HE1' HD13 ' A' ' 65' ' ' ILE . 27.2 ptt? -74.48 -15.61 60.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.777 0.322 . . . . 0.0 111.178 -176.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.58 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -93.94 -5.32 62.69 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.341 175.176 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 44.2 ttt180 -98.79 -5.84 30.44 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -81.54 118.92 23.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.686 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 34.0 ttm105 -92.95 66.73 4.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.503 0.668 . . . . 0.0 110.604 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 95.0 p -138.69 8.0 2.56 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.707 0.765 . . . . 0.0 109.06 167.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -99.99 160.05 28.22 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.535 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.46 101.61 0.54 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.151 1.9 . . . . 0.0 111.509 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 69.0 mt -77.5 136.82 38.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.899 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.508 ' HB3' ' HB2' ' A' ' 89' ' ' TRP . 16.8 ttt180 -66.98 131.81 46.64 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.136 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.423 ' HD2' ' HA ' ' A' ' 87' ' ' LYS . 20.1 tptp -62.9 -52.15 64.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.813 -172.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -89.64 20.34 4.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.501 0.191 . . . . 0.0 111.279 -177.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.508 ' HB2' ' HB3' ' A' ' 86' ' ' ARG . 63.7 t-105 -59.8 -33.35 71.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.947 0.403 . . . . 0.0 110.167 177.52 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.18 -40.65 77.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.333 179.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.5 p -85.82 -9.77 56.51 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -174.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.423 HG23 ' HA ' ' A' ' 89' ' ' TRP . 34.5 m -119.24 -4.43 10.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -176.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -53.21 -44.35 67.95 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.042 0.448 . . . . 0.0 111.676 -176.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -83.28 -20.36 34.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.294 -175.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -75.43 -43.55 49.2 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 61.0 t -64.07 -41.89 93.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.99 177.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 52.6 tpp -58.51 -47.28 84.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.709 175.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -61.48 -42.78 99.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.954 -178.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.7 tttp -65.89 -45.36 82.3 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.817 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.55 -41.99 92.37 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.951 0.405 . . . . 0.0 110.73 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.451 ' HB3' HD21 ' A' ' 152' ' ' LEU . 17.5 mt -58.62 -48.65 80.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.309 177.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.9 ttt85 -58.97 -40.92 86.22 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.711 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.23 -37.15 82.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.126 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.568 ' HA ' HG21 ' A' ' 37' ' ' ILE . 27.1 ttpp -65.69 -42.69 90.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.64 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.603 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 82.3 m-85 -82.5 -24.12 34.32 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -77.74 -41.25 38.33 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 121.867 -0.521 . . . . 0.0 111.112 176.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.69 HE21 ' N ' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -83.31 -11.06 58.11 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.513 -176.276 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -129.24 105.25 8.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.048 0.451 . . . . 0.0 109.937 173.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.49 -30.32 70.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.025 -174.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -69.49 -34.2 73.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.814 0.34 . . . . 0.0 110.397 -179.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 36.2 mt -73.0 -38.19 66.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.611 177.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.603 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 22.7 ttm180 -59.8 -46.36 89.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.178 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.09 97.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.843 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.6 tp -58.13 -50.92 71.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.465 176.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 51.3 tp -58.74 -51.29 70.59 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.546 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 112' ' ' ARG . 31.3 mt -68.5 -22.33 64.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.604 -174.05 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -78.26 -11.91 59.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.842 -178.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 68.8 p -80.52 -29.07 37.24 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.944 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -50.84 135.18 27.66 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.951 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -100.45 27.18 15.21 Favored 'Cis proline' 0 N--CA 1.458 -0.562 0 C-N-CA 124.338 -1.109 . . . . 0.0 113.2 0.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -58.57 150.94 21.67 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 120.92 0.39 . . . . 0.0 111.725 -177.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -87.29 117.71 26.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.49 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 31.6 mt -88.04 127.4 35.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.07 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.584 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 1.8 p -142.85 119.18 5.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.211 0.529 . . . . 0.0 111.007 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -91.57 131.52 36.93 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -91.99 77.13 5.43 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 119.544 -0.862 . . . . 0.0 108.767 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.73 86.13 5.35 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.544 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -85.96 -15.62 40.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.073 -176.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -82.98 -25.43 32.27 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.204 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -152.05 129.65 11.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.594 -176.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.491 ' HB3' ' HA2' ' A' ' 141' ' ' GLY . . . -100.03 85.71 3.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.867 -178.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -158.96 -26.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -177.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.506 ' HB3' HD21 ' A' ' 145' ' ' LEU . 49.1 m95 -131.52 22.01 4.72 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -168.01 -134.27 1.69 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 119.319 -1.42 . . . . 0.0 113.695 -177.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -76.09 -34.45 59.52 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.076 0.465 . . . . 0.0 111.095 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . 0.494 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 79.67 -2.4 73.5 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.651 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 84.93 9.91 79.8 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 121.277 -0.487 . . . . 0.0 112.499 179.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . 0.456 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 30.0 p80 -168.19 23.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.525 0.203 . . . . 0.0 111.103 -178.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 88.14 -51.45 4.0 Favored Glycine 0 CA--C 1.522 0.473 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.591 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.456 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 95.1 mttt -84.53 62.64 7.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.697 0.761 . . . . 0.0 110.655 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.494 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -123.41 15.25 8.13 Favored Glycine 0 C--N 1.315 -0.627 0 CA-C-N 115.221 -0.899 . . . . 0.0 112.548 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.408 ' C ' ' H ' ' A' ' 144' ' ' ARG . 11.1 mptt 63.02 71.33 0.52 Allowed 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 122.962 0.505 . . . . 0.0 111.506 172.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.553 ' OD1' HG23 ' A' ' 124' ' ' VAL . 6.3 t30 -71.92 5.71 2.47 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.284 -178.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.455 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 2.6 mpt_? -49.89 -22.05 1.37 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -179.018 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.506 HD21 ' HB3' ' A' ' 133' ' ' TRP . 62.8 tp -59.23 -45.5 90.98 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.613 0.244 . . . . 0.0 110.598 175.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.594 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -63.52 -30.83 78.77 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.751 176.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -71.77 -36.97 70.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 98.2 mt -62.14 -36.79 82.86 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 174.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.34 -38.81 92.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.337 174.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.594 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 58.1 mtt -64.04 -46.53 84.01 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 177.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -56.54 -51.08 69.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.583 177.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.451 HD21 ' HB3' ' A' ' 101' ' ' LEU . 56.4 tp -63.55 -48.42 77.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.879 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -56.77 -41.07 76.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.872 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . 0.446 ' O ' HG13 ' A' ' 158' ' ' ILE . 1.4 tp10 -61.39 -52.54 64.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.151 -178.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -65.34 -35.48 81.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.53 -175.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.455 ' HB2' HD21 ' A' ' 116' ' ' LEU . 87.4 mt -72.47 -35.01 68.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.856 0.36 . . . . 0.0 110.317 179.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.401 ' O ' HD12 ' A' ' 161' ' ' LEU . . . -68.43 -47.85 66.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.506 177.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 154' ' ' GLU . 73.4 mt -62.24 -37.95 79.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.422 179.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -63.3 -31.8 73.05 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.34 0.59 . . . . 0.0 110.09 177.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -82.77 -12.27 57.64 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.716 179.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 157' ' ' ALA . 7.8 mp -96.51 -35.55 11.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.839 177.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.874 -177.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.453 ' HA ' ' CG ' ' A' ' 25' ' ' ASP . 56.8 t . . . . . 0 C--O 1.235 0.331 0 CA-C-O 121.051 0.453 . . . . 0.0 111.955 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.413 HH21 ' CG ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -83.65 86.45 7.12 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 173.908 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.64 76.55 10.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.066 -175.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 . . . . . 0 C--N 1.323 -0.565 0 CA-C-O 121.267 0.556 . . . . 0.0 109.706 176.746 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-O 120.875 0.369 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 5.5 m -83.47 149.62 4.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 171.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.406 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 0.6 OUTLIER -66.21 -80.21 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.072 -176.645 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.406 ' H ' ' HB2' ' A' ' 12' ' ' MET . 49.2 tt0 -169.32 83.38 0.13 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 173.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.3 t70 62.9 99.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.968 0.793 . . . . 0.0 110.114 -173.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.9 t -120.56 148.08 44.33 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.607 HG13 ' HD2' ' A' ' 122' ' ' LYS . 3.9 mp -86.34 104.74 14.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.968 0.413 . . . . 0.0 110.049 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.6 mt -90.03 89.93 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-O 121.281 0.562 . . . . 0.0 109.881 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.508 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.4 p30 -84.16 102.06 12.3 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 171.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -100.7 137.27 39.32 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.625 -171.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -150.72 -179.34 7.18 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.578 175.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 48.2 m 66.48 93.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.671 0.748 . . . . 0.0 110.666 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.452 HG22 ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -81.39 3.41 24.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.962 -176.025 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 m -46.12 -47.47 17.39 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.348 -0.842 . . . . 0.0 113.255 -175.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.413 ' CG ' HH21 ' A' ' 4' ' ' ARG . 2.6 p-10 -115.11 -175.47 2.7 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.921 -0.487 . . . . 0.0 110.996 -179.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.453 ' CG ' ' HA ' ' A' ' 3' ' ' VAL . 5.0 m-20 -66.35 -26.39 67.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.915 -172.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -70.05 -15.57 63.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.292 0.568 . . . . 0.0 110.277 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -87.17 -0.27 85.3 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.222 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.87 -25.78 63.64 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -56.95 -25.83 58.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.7 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.3 m -70.3 141.85 52.3 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.949 0.404 . . . . 0.0 110.486 177.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -59.06 -33.34 70.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.221 0.534 . . . . 0.0 110.971 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -85.96 20.86 2.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.31 -173.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.452 ' HA ' HG22 ' A' ' 22' ' ' THR . . . -70.21 138.65 51.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.787 0.327 . . . . 0.0 111.144 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.482 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -94.53 64.86 3.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.384 -175.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -117.17 122.87 30.65 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.992 174.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.14 127.66 24.91 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 122.864 2.376 . . . . 0.0 112.532 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.556 ' CG2' ' HA ' ' A' ' 104' ' ' LYS . 11.6 pt -123.9 141.61 43.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.053 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -102.57 87.83 3.09 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.402 HG23 ' HB1' ' A' ' 103' ' ' ALA . 16.0 t -108.41 130.07 61.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.838 -173.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 t70 64.87 26.39 12.87 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.777 0.673 . . . . 0.0 110.159 175.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 77.69 14.36 82.49 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.147 -178.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.9 mttp -125.46 148.71 48.73 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -176.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 35.9 m -93.16 126.46 38.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.702 0.287 . . . . 0.0 111.193 -178.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.438 ' HB2' HG13 ' A' ' 37' ' ' ILE . 35.4 m95 -125.59 133.55 24.99 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.322 178.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 11.9 Cg_exo -71.08 -29.95 16.98 Favored 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 122.763 2.309 . . . . 0.0 112.433 178.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.482 HG22 ' HA ' ' A' ' 34' ' ' ALA . 4.8 p -145.92 169.63 18.22 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.326 -177.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 m -69.42 -44.99 70.24 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.4 0.437 . . . . 0.0 111.971 -173.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.418 ' CD ' ' HG1' ' A' ' 46' ' ' THR . 0.4 OUTLIER -67.35 -15.17 63.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -173.814 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.406 ' O ' HG23 ' A' ' 65' ' ' ILE . 10.5 m80 -63.55 -52.18 62.21 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 174.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -65.96 -37.01 84.9 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.148 0.499 . . . . 0.0 109.931 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.53 -50.11 70.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.424 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -69.84 -37.03 76.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.382 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.616 ' HB3' ' HG3' ' A' ' 62' ' ' ARG . . . -62.83 -54.49 38.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.058 -175.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -73.63 -26.88 60.98 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.804 0.335 . . . . 0.0 110.417 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -56.07 -45.41 79.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.358 172.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -76.09 124.25 27.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.98 176.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.761 ' H ' HD22 ' A' ' 57' ' ' LEU . 1.0 OUTLIER -81.05 -15.64 55.52 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.775 179.552 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -78.01 126.23 30.52 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.435 ' CD ' HH21 ' A' ' 62' ' ' ARG . 10.7 tp10 -67.22 -38.17 84.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.504 -173.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.402 ' O ' ' HB3' ' A' ' 63' ' ' GLU . 41.7 mttm -83.41 -25.4 31.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -175.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.526 ' OH ' ' HE3' ' A' ' 83' ' ' LYS . 0.3 OUTLIER -80.82 -23.28 39.32 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.355 -0.938 . . . . 0.0 109.918 173.785 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.616 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 24.9 ttp180 -68.98 -35.58 76.89 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 167.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.402 ' HB3' ' O ' ' A' ' 60' ' ' LYS . 42.1 tt0 -64.83 -36.24 83.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.037 174.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.423 ' CD ' HH21 ' A' ' 67' ' ' ARG . 5.9 tp10 -58.93 -42.89 90.83 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.434 173.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.434 HD11 ' HE1' ' A' ' 77' ' ' MET . 45.6 mm -60.35 -37.13 73.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.979 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -72.15 -32.11 66.59 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.028 0.442 . . . . 0.0 110.415 175.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.423 HH21 ' CD ' ' A' ' 64' ' ' GLU . 35.1 ttp180 -70.57 -26.5 63.56 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.177 -175.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.2 m -87.49 121.97 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 121.485 0.66 . . . . 0.0 110.987 178.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.0 p -83.33 -13.42 55.12 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 173.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.9 m -85.89 117.48 68.8 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.455 -176.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.64 -46.62 0.82 Allowed 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 123.056 2.504 . . . . 0.0 111.954 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.9 tpt -62.51 -33.07 74.15 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.295 -176.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 93.9 t -69.29 -43.36 81.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.199 178.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.71 -38.74 92.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.619 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.99 -45.97 86.64 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.864 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 76' ' ' ARG . 42.4 mtm180 -62.59 -48.22 80.37 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.634 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.749 ' HA ' ' HB2' ' A' ' 80' ' ' ASP . 26.6 ptt? -75.47 -11.06 59.96 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.458 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.32 -32.01 65.56 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.284 -0.726 . . . . 0.0 111.284 169.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -96.64 11.13 36.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.613 0.244 . . . . 0.0 110.918 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.749 ' HB2' ' HA ' ' A' ' 77' ' ' MET . 28.1 t70 -67.2 -19.54 65.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.738 -175.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 74.29 -41.29 0.47 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.653 0.781 . . . . 0.0 111.966 177.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.8 m -83.06 33.15 0.44 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.183 0.516 . . . . 0.0 111.176 -178.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.526 ' HE3' ' OH ' ' A' ' 61' ' ' TYR . 47.4 mmtm -123.32 158.78 57.38 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.698 -178.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.18 103.04 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.603 2.202 . . . . 0.0 112.754 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 83' ' ' LYS . 73.7 mt -105.55 154.49 20.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.978 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.55 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 52.7 mtt180 -99.03 136.27 39.24 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.88 0.371 . . . . 0.0 110.866 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -60.95 -33.7 73.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.855 175.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -95.91 11.45 33.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.99 -176.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.552 ' O ' ' HB2' ' A' ' 93' ' ' LYS . 61.8 t-105 -63.92 -33.58 76.04 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.479 -174.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.82 -23.52 66.7 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.921 0.391 . . . . 0.0 110.681 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.7 m -91.87 -46.05 8.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.235 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.78 2.36 5.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.662 0.268 . . . . 0.0 111.705 -175.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.552 ' HB2' ' O ' ' A' ' 89' ' ' TRP . 35.1 ttmt -55.75 -53.64 54.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.597 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -62.46 -35.0 77.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.089 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -66.63 -51.59 54.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.696 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.2 t -64.31 -40.57 89.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.29 178.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.849 ' HA ' ' HE2' ' A' ' 97' ' ' MET . 2.1 tpt -59.29 -48.85 80.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.677 178.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 44.5 ttp180 -62.48 -35.85 80.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.321 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -64.04 -45.57 88.26 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.153 0.501 . . . . 0.0 110.248 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.52 -42.98 95.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.549 177.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 97' ' ' MET . 92.8 mt -62.05 -36.16 80.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.156 178.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.512 ' HG3' HD11 ' A' ' 152' ' ' LEU . 59.2 ttp85 -62.63 -49.17 76.23 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.186 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.485 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -66.83 -29.75 69.76 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.185 0.517 . . . . 0.0 110.236 -178.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.556 ' HA ' ' CG2' ' A' ' 37' ' ' ILE . 57.5 tttp -59.91 -59.18 5.83 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.296 177.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.499 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 90.2 m-85 -80.07 -40.54 27.43 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.521 ' HA ' ' HD3' ' A' ' 112' ' ' ARG . 2.4 tm-20 -69.73 -37.99 76.69 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 121.154 -0.219 . . . . 0.0 111.385 -173.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.1 tp-100 -65.05 -35.74 82.14 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.045 0.45 . . . . 0.0 110.552 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -108.83 101.45 10.56 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.91 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -53.25 -34.42 57.08 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 112.077 -175.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.78 -44.91 86.56 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.068 177.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 68.1 mt -73.73 -38.87 64.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.525 -177.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.71 ' HG3' HD11 ' A' ' 156' ' ' LEU . 41.9 ttp180 -62.15 -47.98 82.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.531 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.81 -34.67 77.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.023 0.44 . . . . 0.0 110.391 178.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 50.5 tp -63.29 -41.62 98.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.15 177.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 32.2 tp -63.49 -49.25 74.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.304 178.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.98 -19.16 65.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.556 -178.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.29 11.21 12.68 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.5 0.555 . . . . 0.0 112.5 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 75.7 p -101.41 -25.39 13.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.887 0.375 . . . . 0.0 110.762 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.456 ' HB3' ' HD2' ' A' ' 153' ' ' ARG . . . -51.33 137.99 28.91 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.691 -178.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -99.41 31.25 11.35 Favored 'Cis proline' 0 N--CA 1.458 -0.567 0 C-N-CA 124.276 -1.135 . . . . 0.0 113.306 -0.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.23 154.44 38.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.764 0.316 . . . . 0.0 111.274 -178.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.607 ' HD2' HG13 ' A' ' 16' ' ' ILE . 61.4 mttp -80.01 134.55 36.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.075 179.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.441 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 80.8 mt -102.97 113.69 27.37 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.125 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.508 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 26.6 t -131.95 116.25 29.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.503 -178.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -78.87 111.99 15.58 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 174.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.609 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 86.4 t60 -91.61 77.27 5.68 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -177.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.419 ' O ' HG22 ' A' ' 127' ' ' THR . 10.4 t -83.63 92.08 7.59 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 122.328 1.061 . . . . 0.0 109.106 177.147 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -79.96 59.22 3.14 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.189 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -144.48 -51.55 0.29 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.584 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -153.67 128.91 9.75 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.184 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.524 ' HB3' ' HA2' ' A' ' 141' ' ' GLY . . . -76.76 105.47 7.84 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.068 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -151.03 -46.14 0.12 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 120.642 -0.423 . . . . 0.0 112.128 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.689 ' HB3' HD21 ' A' ' 145' ' ' LEU . 7.8 m95 -126.54 35.19 4.68 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -176.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -172.31 -123.1 0.69 Allowed Glycine 0 CA--C 1.506 -0.519 0 C-N-CA 119.237 -1.459 . . . . 0.0 112.87 -177.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.505 ' HB2' ' HA2' ' A' ' 139' ' ' GLY . 1.5 p-10 -107.13 -17.11 14.25 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.308 0.575 . . . . 0.0 109.576 176.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . 0.405 ' HA3' ' CB ' ' A' ' 131' ' ' ALA . . . 64.6 18.94 64.32 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.773 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.609 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 86.11 10.89 74.01 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.042 -0.599 . . . . 0.0 113.303 -179.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -163.72 23.08 0.08 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 117.453 0.627 . . . . 0.0 112.206 -178.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . 0.505 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 81.65 -49.82 4.13 Favored Glycine 0 CA--C 1.524 0.611 0 C-N-CA 120.86 -0.686 . . . . 0.0 113.703 176.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -81.14 60.24 4.2 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.642 0.734 . . . . 0.0 110.275 -175.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.524 ' HA2' ' HB3' ' A' ' 131' ' ' ALA . . . -125.31 15.41 7.25 Favored Glycine 0 C--N 1.317 -0.499 0 CA-C-N 115.277 -0.874 . . . . 0.0 113.495 -179.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 67.1 mttm 70.44 79.47 0.18 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.547 0.689 . . . . 0.0 111.006 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.81 5.34 2.61 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.084 -177.504 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.471 ' NE ' ' HA ' ' A' ' 144' ' ' ARG . 3.7 mmp_? -54.61 -29.96 53.32 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.689 HD21 ' HB3' ' A' ' 133' ' ' TRP . 54.2 tp -61.18 -49.91 75.29 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.051 0.453 . . . . 0.0 110.463 177.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.603 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -61.23 -32.51 80.9 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.973 177.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -72.9 -36.81 67.38 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.594 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.6 mt -59.43 -37.23 77.55 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.57 -39.89 94.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.663 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.603 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 52.9 mtt -64.73 -50.5 66.65 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.096 0.474 . . . . 0.0 110.275 177.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -60.42 -43.2 96.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.933 -178.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.512 HD11 ' HG3' ' A' ' 102' ' ' ARG . 44.8 tp -65.24 -40.84 94.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.462 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.456 ' HD2' ' HB3' ' A' ' 119' ' ' ALA . 51.6 ttp85 -56.69 -44.67 81.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.771 178.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . 0.492 ' O ' HG13 ' A' ' 158' ' ' ILE . 26.2 tt0 -71.78 -36.05 70.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.521 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 58.3 tp60 -61.66 -43.12 99.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.089 0.471 . . . . 0.0 110.292 176.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.71 HD11 ' HG3' ' A' ' 112' ' ' ARG . 93.1 mt -71.56 -29.83 65.18 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.55 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.406 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -63.42 -38.67 92.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.375 176.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 154' ' ' GLU . 75.1 mt -57.97 -43.26 84.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.56 176.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -61.44 -40.21 93.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.169 177.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -71.87 -23.25 61.48 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.749 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 157' ' ' ALA . 5.0 mp -79.09 -40.54 30.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.191 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 . . . . . 0 C--N 1.325 -0.498 0 CA-C-O 121.089 0.471 . . . . 0.0 110.631 177.725 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 120.733 0.301 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -87.24 89.63 8.06 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.403 ' O ' HD13 ' A' ' 114' ' ' LEU . . . -92.43 -67.26 0.87 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.078 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.45 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -177.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 . . . . . 0 N--CA 1.456 -0.175 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.508 HG23 ' HD2' ' A' ' 120' ' ' PRO . 5.7 m -72.0 135.43 27.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.051 0.453 . . . . 0.0 110.636 175.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.423 ' HE2' HG23 ' A' ' 15' ' ' THR . 0.0 OUTLIER -79.59 14.06 1.8 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.83 -176.971 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 69.77 159.54 0.19 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.468 0.707 . . . . 0.0 111.053 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 51.03 29.72 4.8 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.382 0.611 . . . . 0.0 110.99 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.423 HG23 ' HE2' ' A' ' 12' ' ' MET . 20.4 m -86.87 124.28 32.92 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.281 -174.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 56.3 mt -110.66 115.48 49.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 169.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.2 mt -89.81 106.16 16.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.233 0.539 . . . . 0.0 110.286 -176.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.585 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 8.0 t-20 -106.65 126.86 52.82 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.591 -177.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.438 ' O ' ' HG3' ' A' ' 125' ' ' GLU . 27.2 p90 -128.78 -175.15 3.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.912 -178.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.416 ' C ' ' HG ' ' A' ' 21' ' ' SER . 1.0 OUTLIER -142.19 104.72 4.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.11 -177.261 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.416 ' HG ' ' C ' ' A' ' 20' ' ' TYR . 79.7 p 53.92 -166.33 0.08 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.622 0.769 . . . . 0.0 112.207 175.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.706 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 0.2 OUTLIER -81.71 -59.45 2.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.998 0.428 . . . . 0.0 110.232 178.66 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t 59.26 -96.34 0.06 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.444 175.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -144.24 -67.91 0.33 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.016 0.436 . . . . 0.0 111.732 -175.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -81.05 -79.4 0.16 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -165.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -88.92 -1.76 58.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.192 0.52 . . . . 0.0 111.532 -171.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.706 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -66.82 -0.63 9.1 Favored Glycine 0 CA--C 1.52 0.387 0 CA-C-N 116.019 -0.537 . . . . 0.0 114.231 -175.199 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.566 ' CG ' ' HZ3' ' A' ' 104' ' ' LYS . 23.4 t70 -50.68 -32.1 18.31 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 117.332 0.566 . . . . 0.0 111.96 178.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -72.58 -12.54 61.1 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 98.6 p -77.3 126.89 31.65 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.843 177.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -51.15 -23.18 3.03 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -175.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.48 ' CZ ' ' HB2' ' A' ' 71' ' ' PRO . 54.1 t80 -62.4 -62.38 1.79 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 174.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.551 ' HA ' HG23 ' A' ' 22' ' ' THR . . . 32.26 -149.7 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.272 1.029 . . . . 0.0 113.753 -176.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -166.24 66.2 0.11 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.407 177.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.489 ' O ' ' HA ' ' A' ' 46' ' ' THR . 94.6 m95 -131.1 121.65 18.83 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.629 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.485 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 19.2 Cg_endo -59.4 126.55 21.08 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.854 2.37 . . . . 0.0 112.515 178.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.2 pt -119.86 157.74 22.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.155 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -119.42 95.34 4.75 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -177.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 t -131.09 142.31 43.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.174 -0.467 . . . . 0.0 109.971 -176.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.8 t70 67.14 17.06 10.35 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.817 0.818 . . . . 0.0 109.58 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 72.19 22.23 78.94 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.353 -174.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.3 tppt? -121.82 149.92 42.64 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -176.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.7 m -94.95 113.51 25.23 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.872 0.368 . . . . 0.0 110.156 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.485 ' O ' ' HA ' ' A' ' 36' ' ' PRO . 41.6 m95 -109.89 123.47 36.17 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.436 ' O ' ' HB ' ' A' ' 46' ' ' THR . 39.8 Cg_exo -58.94 -11.9 13.65 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 123.053 2.502 . . . . 0.0 113.794 -177.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.489 ' HA ' ' O ' ' A' ' 35' ' ' TRP . 8.9 t 177.57 170.11 0.63 Allowed 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 174.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -40.59 88.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -175.172 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -48.17 -42.57 30.08 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.195 0.31 . . . . 0.0 111.785 176.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -64.64 -41.86 95.85 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.181 -176.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -69.95 -43.52 71.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.215 0.531 . . . . 0.0 110.179 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.433 ' HA ' HG11 ' A' ' 96' ' ' VAL . 89.5 t80 -61.26 -42.36 98.5 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.497 178.301 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.637 ' HG3' HD12 ' A' ' 65' ' ' ILE . 5.3 tp-100 -68.83 -45.56 70.84 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.885 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.467 ' HB1' ' CG ' ' A' ' 62' ' ' ARG . . . -65.9 -47.43 74.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.762 -177.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -75.23 -13.69 60.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.569 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.722 ' HZ1' ' HB2' ' A' ' 55' ' ' LYS . 4.9 ttmp? -59.23 -33.19 70.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.077 0.465 . . . . 0.0 110.532 171.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.544 ' CE1' ' HG3' ' A' ' 83' ' ' LYS . 56.9 m-85 -107.32 166.99 10.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.971 -176.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.677 ' H ' HD22 ' A' ' 57' ' ' LEU . 2.5 pt? -115.08 11.37 16.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.043 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -97.15 123.22 40.85 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.225 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.15 -40.13 86.64 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.101 -173.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -60.21 -53.77 53.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.923 0.392 . . . . 0.0 110.348 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.486 ' O ' HG13 ' A' ' 65' ' ' ILE . 3.1 t80 -66.44 -32.81 74.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.592 -177.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.467 ' CG ' ' HB1' ' A' ' 53' ' ' ALA . 44.4 ttm-85 -60.6 -49.41 77.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.019 0.437 . . . . 0.0 110.313 178.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -78.4 -15.15 58.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.109 0.48 . . . . 0.0 110.354 -178.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -74.66 -40.31 61.51 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.637 HD12 ' HG3' ' A' ' 52' ' ' GLN . 72.0 mt -70.39 -25.81 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.124 174.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.07 -22.06 53.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.854 174.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 73.4 ttt-85 -80.99 -29.97 35.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.958 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.492 HG22 ' HB ' ' A' ' 73' ' ' VAL . 14.9 p -75.8 126.61 36.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.235 0.54 . . . . 0.0 110.736 -179.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m -74.44 -41.75 60.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.506 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 30.2 t -69.09 130.05 91.63 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.069 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.48 ' HB2' ' CZ ' ' A' ' 32' ' ' PHE . 7.2 Cg_exo -73.45 -26.07 14.6 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.592 2.194 . . . . 0.0 111.322 174.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.5 tpt -70.44 -43.27 70.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.321 -177.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.492 ' HB ' HG22 ' A' ' 68' ' ' VAL . 59.8 t -63.84 -34.09 66.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.048 177.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.14 -49.53 74.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.472 177.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.478 ' HA ' HE21 ' A' ' 52' ' ' GLN . . . -60.16 -37.42 80.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.551 177.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -62.08 -33.93 75.34 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.758 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.503 ' SD ' HG12 ' A' ' 65' ' ' ILE . 56.1 mtt -65.72 -50.69 63.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.131 0.491 . . . . 0.0 111.473 -179.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.599 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -94.3 4.42 70.32 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.29 -0.957 . . . . 0.0 113.568 -174.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 5.3 tpp180 -71.24 -25.13 62.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.908 0.354 . . . . 0.0 111.211 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -99.37 131.97 45.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.152 0.501 . . . . 0.0 109.701 177.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.429 ' C ' ' H ' ' A' ' 83' ' ' LYS . 44.5 mtm180 -101.35 29.88 4.52 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.397 -172.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.4 p -82.7 19.73 1.27 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.574 0.702 . . . . 0.0 109.935 174.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.544 ' HG3' ' CE1' ' A' ' 56' ' ' PHE . 41.1 mmtm -89.22 169.72 12.36 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.703 178.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.523 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 16.8 Cg_endo -60.14 -29.13 88.42 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.332 2.021 . . . . 0.0 111.537 170.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.7 mt 67.72 -174.06 0.19 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.129 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.447 ' HB3' ' HB2' ' A' ' 89' ' ' TRP . 57.0 ttt-85 -134.18 142.27 47.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.811 -176.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -64.37 -68.41 0.36 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.799 -175.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -81.96 25.94 0.54 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.411 -174.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.491 ' CZ2' ' HE3' ' A' ' 55' ' ' LYS . 58.5 t-105 -61.0 -33.11 72.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.117 0.484 . . . . 0.0 110.104 177.294 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.412 ' O ' ' HE3' ' A' ' 93' ' ' LYS . 40.3 tt0 -55.92 -35.78 66.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.071 -178.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.1 p -99.93 -8.52 23.88 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -173.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.483 HG23 ' HA ' ' A' ' 89' ' ' TRP . 33.7 m -108.74 1.81 9.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -175.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.663 ' HB2' ' HZ2' ' A' ' 93' ' ' LYS . 10.0 mtmp? -54.92 -57.69 10.63 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.593 0.711 . . . . 0.0 110.49 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.472 ' CD ' ' H ' ' A' ' 94' ' ' GLU . 1.9 pm0 -78.14 -14.94 59.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.134 -178.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.534 ' O ' ' HD3' ' A' ' 99' ' ' LYS . 34.0 tt0 -73.11 -52.37 14.5 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 176.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.433 HG11 ' HA ' ' A' ' 51' ' ' PHE . 96.8 t -58.44 -41.41 81.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.996 177.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.402 ' HE1' ' CG ' ' A' ' 51' ' ' PHE . 16.6 mmt -60.46 -39.0 86.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.281 176.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 38.1 ttm-85 -61.56 -38.45 87.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.524 0.202 . . . . 0.0 111.105 -178.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.534 ' HD3' ' O ' ' A' ' 95' ' ' GLN . 0.3 OUTLIER -71.03 -48.17 54.46 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.916 0.388 . . . . 0.0 110.805 176.23 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.2 -42.86 99.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.466 -177.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.6 -38.56 84.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.182 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 52.1 ttt180 -63.3 -48.17 79.2 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.06 178.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.02 -38.01 78.26 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.981 0.419 . . . . 0.0 110.408 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.566 ' HZ3' ' CG ' ' A' ' 28' ' ' ASP . 60.4 tttm -62.11 -52.37 64.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.323 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 68.5 m-85 -81.96 -41.66 20.49 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -174.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -75.42 -39.59 58.76 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 121.969 -0.457 . . . . 0.0 111.197 -173.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -74.63 -31.19 61.91 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.796 0.331 . . . . 0.0 110.662 -178.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -100.21 97.55 8.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.31 66.04 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -171.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -68.14 -32.45 72.74 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.038 -178.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.502 HD11 ' HZ1' ' A' ' 104' ' ' LYS . 42.4 mt -74.34 -37.15 63.61 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.546 ' HG3' HD13 ' A' ' 156' ' ' LEU . 24.5 ttm180 -58.23 -50.26 74.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.121 177.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.95 -39.88 95.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.724 -179.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 5' ' ' ALA . 58.6 tp -59.46 -48.83 80.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.583 177.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 44.1 tp -62.93 -39.61 95.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.993 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.402 HD21 ' HB2' ' A' ' 156' ' ' LEU . 80.5 mt -76.61 -15.03 59.94 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -82.97 -18.18 40.84 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.71 0.291 . . . . 0.0 111.159 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 66.2 p -72.44 -35.01 68.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.031 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.66 138.47 16.87 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.793 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . 0.508 ' HD2' HG23 ' A' ' 11' ' ' VAL . 43.1 Cg_endo -95.72 29.16 15.96 Favored 'Cis proline' 0 CA--C 1.533 0.458 0 C-N-CA 124.147 -1.189 . . . . 0.0 113.657 1.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.19 153.32 43.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.88 0.372 . . . . 0.0 111.354 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -92.29 134.81 34.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.261 -177.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 40.1 mt -98.5 109.45 22.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.88 0.372 . . . . 0.0 110.708 -177.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.585 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 91.2 t -139.41 122.72 18.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.447 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 19' ' ' PHE . 87.6 tt0 -101.31 118.19 36.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.088 0.47 . . . . 0.0 110.77 176.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' HIS . . . . . 0.766 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 57.4 t60 -89.92 81.76 6.25 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 173.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 14.5 t -120.86 143.52 48.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.304 -178.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -118.56 9.03 12.14 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.403 0.62 . . . . 0.0 109.808 175.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -62.24 -33.33 74.38 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.468 176.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -155.52 119.0 4.41 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.449 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -80.73 85.51 6.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.225 0.536 . . . . 0.0 110.787 -175.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.697 ' HA ' ' O ' ' A' ' 141' ' ' GLY . 40.2 t80 179.01 153.03 0.38 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.559 -1.2 . . . . 0.0 107.911 173.144 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.628 ' O ' ' HB3' ' A' ' 145' ' ' LEU . 84.1 m95 78.73 -19.19 0.46 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.557 0.743 . . . . 0.0 111.537 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.443 ' HA2' ' HA ' ' A' ' 143' ' ' ASN . . . -138.04 -152.82 6.12 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.373 -174.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.766 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 20.4 t70 -67.46 -24.86 65.65 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.156 0.503 . . . . 0.0 110.802 178.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' GLY . . . . . 0.514 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 72.51 8.32 71.09 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.506 178.357 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 88.17 -10.66 70.13 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.408 -0.425 . . . . 0.0 113.103 178.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . 0.587 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 24.9 p80 -160.63 30.12 0.16 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.928 0.364 . . . . 0.0 111.625 -173.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 84.35 -51.37 4.55 Favored Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.813 -0.708 . . . . 0.0 113.191 177.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.587 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 53.1 mttp -75.49 55.4 0.81 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.073 0.463 . . . . 0.0 111.676 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.697 ' O ' ' HA ' ' A' ' 132' ' ' TYR . . . -123.7 -4.84 7.91 Favored Glycine 0 C--O 1.223 -0.576 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.0 176.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.433 ' C ' ' H ' ' A' ' 144' ' ' ARG . 2.9 mptp? 61.4 84.2 0.14 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.962 0.381 . . . . 0.0 111.722 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.443 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 8.0 t30 -68.08 5.73 0.87 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.412 1.085 . . . . 0.0 111.597 -178.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.433 ' H ' ' C ' ' A' ' 142' ' ' LYS . 14.0 tpt180 -33.06 -31.05 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.542 1.137 . . . . 0.0 113.276 176.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.628 ' HB3' ' O ' ' A' ' 133' ' ' TRP . 25.5 tp -68.23 -49.23 62.12 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 117.944 0.338 . . . . 0.0 110.957 -179.268 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -61.47 -32.54 81.51 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.251 -0.74 . . . . 0.0 111.251 177.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -69.01 -43.25 75.17 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 175.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.5 -48.79 76.44 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.439 175.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.82 -42.08 88.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.892 178.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 73.1 mtm -69.04 -37.46 78.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.331 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -60.57 -51.63 68.59 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.705 0.288 . . . . 0.0 110.253 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.456 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 64.3 tp -60.11 -43.07 95.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.416 178.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.403 ' NH1' ' HG3' ' A' ' 154' ' ' GLU . 2.4 ttt-85 -51.85 -56.95 10.92 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.676 177.352 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . 0.478 ' O ' HG13 ' A' ' 158' ' ' ILE . 35.8 mt-10 -72.86 -22.98 60.69 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.213 -178.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -68.57 -39.14 81.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.222 174.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.546 HD13 ' HG3' ' A' ' 112' ' ' ARG . 96.0 mt -67.93 -31.25 70.87 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.108 0.48 . . . . 0.0 109.892 179.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.538 ' O ' HD11 ' A' ' 161' ' ' LEU . . . -67.38 -46.08 74.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.34 175.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 154' ' ' GLU . 85.2 mt -65.72 -34.39 70.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -59.67 -34.35 72.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.303 0.573 . . . . 0.0 109.943 175.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -79.14 -18.81 52.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.667 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' LEU . . . . . 0.538 HD11 ' O ' ' A' ' 157' ' ' ALA . 6.1 mp -78.43 -25.06 45.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.114 0.483 . . . . 0.0 110.619 176.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.324 178.327 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.5 tmm? . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -96.9 115.2 0.13 Allowed 'Trans proline' 0 N--CA 1.447 -1.229 0 C-N-CA 123.333 2.689 . . . . 0.0 112.661 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.4 t -76.37 84.77 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 175.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -131.12 153.83 48.96 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.657 -176.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.51 136.15 42.2 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 163.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.579 ' HB3' ' HA ' ' A' ' 9' ' ' GLN . 73.7 mm-40 66.97 69.41 0.4 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.656 0.597 . . . . 0.0 110.538 -173.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -58.11 -53.48 57.79 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 174.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 66.8 mt -100.8 107.53 21.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 164.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.579 ' HA ' ' HB3' ' A' ' 6' ' ' GLN . 76.8 mt-30 -61.25 94.12 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 O-C-N 123.693 0.621 . . . . 0.0 110.677 -175.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.6 t60 60.64 98.7 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.123 0 O-C-N 123.968 0.792 . . . . 0.0 110.432 -174.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -61.53 168.85 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 111.09 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.45 ' O ' ' HB2' ' A' ' 13' ' ' GLN . 4.5 mtt -64.09 -85.5 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.215 -174.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.45 ' HB2' ' O ' ' A' ' 12' ' ' MET . 8.8 tt0 169.89 120.49 0.01 OUTLIER 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.759 -177.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 65.03 26.16 12.62 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.24 0.543 . . . . 0.0 110.509 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.46 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 29.3 m -76.87 110.97 11.92 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.299 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.9 mm -77.35 108.36 10.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.9 mt -95.82 99.32 9.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.764 -177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.75 106.67 18.67 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 173.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -117.47 132.8 56.49 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.036 -175.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -150.48 100.36 2.86 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.773 167.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.9 m 177.89 88.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 O-C-N 124.065 0.853 . . . . 0.0 109.458 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.663 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 1.3 m -79.87 2.63 22.55 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.994 0.426 . . . . 0.0 111.473 -174.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.1 m -91.42 -8.32 48.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.706 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -131.18 -165.5 1.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.305 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -65.7 -26.46 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.364 -172.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -80.38 -2.49 45.75 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.92 0.39 . . . . 0.0 111.034 177.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.663 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -83.26 -16.84 68.19 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.728 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -68.25 -26.64 65.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.071 0.462 . . . . 0.0 110.898 -179.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -69.28 -26.17 64.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.31 178.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.3 m -76.08 126.76 31.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 171.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -60.46 -20.71 60.85 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -76.51 4.71 8.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.116 0.484 . . . . 0.0 111.225 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -66.75 131.46 46.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.749 0.309 . . . . 0.0 110.678 176.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.481 ' HA ' HG23 ' A' ' 46' ' ' THR . . . -80.93 58.83 3.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.198 0.523 . . . . 0.0 111.681 -175.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -102.34 117.64 60.66 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.822 174.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.6 125.14 17.8 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.956 2.438 . . . . 0.0 112.556 -176.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.737 HG23 ' HA ' ' A' ' 104' ' ' LYS . 29.5 pt -114.4 139.34 40.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.299 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -102.54 105.09 15.55 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.431 HG23 ' CB ' ' A' ' 103' ' ' ALA . 4.0 t -128.57 123.12 58.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.263 -173.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 59.21 27.21 16.16 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.191 174.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.61 -5.62 57.01 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.563 -0.827 . . . . 0.0 113.433 175.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.502 ' HD3' ' HD2' ' A' ' 66' ' ' ARG . 60.9 mttm -124.05 156.9 35.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 117.596 0.698 . . . . 0.0 111.373 -178.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.1 m -100.54 117.04 33.88 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.266 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.488 ' HB2' HG13 ' A' ' 37' ' ' ILE . 41.1 m95 -105.86 133.92 19.98 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.431 -179.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 43.8 Cg_exo -58.43 -41.27 67.17 Favored 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 122.66 2.24 . . . . 0.0 112.752 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.481 HG23 ' HA ' ' A' ' 34' ' ' ALA . 77.9 p -148.24 172.14 14.82 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -33.49 75.18 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -177.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 48' ' ' GLU . 3.6 mp0 -61.3 -28.55 69.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.947 0.403 . . . . 0.0 110.904 -177.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.442 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 57.1 m80 -65.91 -48.01 72.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.401 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -72.75 -35.99 67.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.335 0.588 . . . . 0.0 109.758 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -59.58 -49.1 79.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.028 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.418 ' HA ' ' CB ' ' A' ' 55' ' ' LYS . 37.2 mt-30 -85.97 -13.31 48.02 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.682 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.471 ' HB3' ' HG3' ' A' ' 62' ' ' ARG . . . -69.43 -30.43 68.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.26 0.552 . . . . 0.0 109.961 173.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -90.8 -21.76 21.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.649 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.418 ' CB ' ' HA ' ' A' ' 52' ' ' GLN . 83.0 tttt -58.12 -53.31 59.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.2 0.524 . . . . 0.0 110.606 176.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -91.56 142.05 28.05 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.75 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.679 HD21 ' H ' ' A' ' 57' ' ' LEU . 2.4 pt? -98.5 10.13 41.62 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 173.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -67.51 112.34 4.63 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.762 174.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -50.98 -61.82 1.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.022 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -77.16 -18.27 57.96 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.866 -171.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.531 ' O ' HG13 ' A' ' 65' ' ' ILE . 3.9 t80 -80.58 -35.64 33.95 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.471 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 33.5 ttm180 -59.21 -44.44 92.26 Favored 'General case' 0 CA--C 1.521 -0.144 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 173.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.42 -39.72 76.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.495 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.438 ' CD ' HH21 ' A' ' 67' ' ' ARG . 7.8 tp10 -63.0 -49.24 75.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.916 0.389 . . . . 0.0 110.682 177.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 61' ' ' TYR . 3.5 mt -70.19 -22.78 24.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.185 0.517 . . . . 0.0 110.877 -177.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.502 ' HD2' ' HD3' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -78.46 -29.27 46.77 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.211 176.891 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.438 HH21 ' CD ' ' A' ' 64' ' ' GLU . 56.5 ttp180 -86.02 -35.44 20.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.638 -175.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.4 p -65.43 117.4 6.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.474 0.654 . . . . 0.0 111.22 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.2 m -77.14 -33.72 56.66 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.593 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.3 m -66.24 126.55 92.2 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.335 -178.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.442 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 54.4 Cg_endo -71.86 -40.64 2.56 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.828 2.352 . . . . 0.0 113.281 -179.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 87.0 mtp -70.29 -29.8 66.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.745 0.307 . . . . 0.0 110.74 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.513 ' O ' ' HG3' ' A' ' 77' ' ' MET . 99.6 t -66.74 -39.51 83.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.558 178.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.476 ' HA ' ' HE3' ' A' ' 77' ' ' MET . . . -61.36 -39.36 90.33 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 120.92 0.391 . . . . 0.0 110.369 177.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.64 -38.27 80.34 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.711 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -65.97 -57.36 8.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.954 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.513 ' HG3' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -83.26 -13.04 56.08 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.319 -0.553 . . . . 0.0 111.159 -176.58 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.34 -10.33 60.87 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.644 -0.788 . . . . 0.0 111.607 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.72 -40.46 66.09 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 122.742 0.417 . . . . 0.0 111.647 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.437 ' OD2' ' HG3' ' A' ' 83' ' ' LYS . 30.3 t70 -59.73 137.47 58.03 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.015 -170.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 87.1 mtm-85 -116.96 18.54 14.67 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.059 176.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.4 m -90.91 -28.96 17.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.663 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.439 ' NZ ' ' HB3' ' A' ' 83' ' ' LYS . 6.1 mtpm? -63.31 156.69 68.26 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.257 176.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.05 113.62 1.66 Allowed 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.43 2.087 . . . . 0.0 111.786 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 67.0 mt -101.04 163.75 12.14 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.485 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.422 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 23.6 mtp180 -67.26 139.27 57.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.842 0.353 . . . . 0.0 110.446 176.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 43.2 mtpt -60.64 -28.41 68.54 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.495 0.664 . . . . 0.0 110.604 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -104.07 12.96 33.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.413 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.476 ' HA ' HG23 ' A' ' 92' ' ' VAL . 50.3 t-105 -59.98 -33.65 72.24 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.534 -176.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.647 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 18.3 mm-40 -65.65 -24.32 67.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.398 -179.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.3 t -99.68 -44.78 5.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.299 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.476 HG23 ' HA ' ' A' ' 89' ' ' TRP . 33.7 m -73.96 3.01 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -170.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.647 ' NZ ' ' HA ' ' A' ' 90' ' ' GLU . 56.7 mttp -56.79 -42.35 79.32 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 175.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.477 ' O ' ' HB2' ' A' ' 98' ' ' ARG . 52.1 mt-10 -61.13 -39.5 90.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.833 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -69.19 -50.88 43.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.368 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 59.6 t -63.78 -49.37 82.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.776 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.487 ' SD ' HD13 ' A' ' 145' ' ' LEU . 50.7 ttm -66.2 -36.06 82.08 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.335 -177.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.477 ' HB2' ' O ' ' A' ' 94' ' ' GLU . 20.3 ttt180 -61.31 -43.16 99.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.832 0.349 . . . . 0.0 110.664 -179.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -70.51 -35.34 73.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.572 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.88 88.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.732 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 145' ' ' LEU . 94.0 mt -64.46 -40.3 95.44 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.53 176.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.481 ' O ' ' HB2' ' A' ' 106' ' ' GLU . 34.2 ttm180 -54.17 -54.46 39.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.1 175.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.431 ' CB ' HG23 ' A' ' 39' ' ' VAL . . . -62.05 -34.43 76.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.457 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.737 ' HA ' HG23 ' A' ' 37' ' ' ILE . 64.4 tttm -63.96 -56.1 17.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.249 -178.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 71.2 m-85 -78.38 -28.0 46.96 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -175.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.481 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -79.02 -40.58 31.04 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.09 -177.464 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -69.61 -14.67 62.95 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.05 0.452 . . . . 0.0 110.884 -176.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -124.98 105.97 9.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.359 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -56.67 -31.43 64.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.96 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.05 -47.41 81.03 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.964 177.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 36.0 mt -74.49 -39.85 62.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.763 -175.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.574 ' HG3' HD11 ' A' ' 156' ' ' LEU . 61.9 ttt180 -59.12 -48.45 81.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.451 178.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.8 -35.14 80.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.553 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 62.2 tp -64.61 -37.15 86.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.61 176.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.483 ' HG ' ' HB2' ' A' ' 153' ' ' ARG . 16.5 tp -64.02 -50.52 68.14 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.099 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.477 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 4.6 mp -67.44 -19.71 65.4 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.82 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -67.67 -30.15 69.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.511 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.439 ' HB ' HD22 ' A' ' 123' ' ' LEU . 70.0 p -81.3 -0.46 41.06 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 120.758 0.313 . . . . 0.0 111.683 -177.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.518 ' HB1' ' HD2' ' A' ' 153' ' ' ARG . . . -86.33 139.94 34.17 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 170.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -99.11 74.67 0.14 OUTLIER 'Cis proline' 0 N--CA 1.454 -0.799 0 C-N-CA 124.468 -1.055 . . . . 0.0 113.291 -0.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.46 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -111.0 176.4 5.04 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -120.83 120.53 35.83 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.996 0.426 . . . . 0.0 110.272 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.439 HD22 ' HB ' ' A' ' 118' ' ' THR . 9.1 mt -86.32 125.85 33.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.787 -173.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.2 t -130.83 116.85 35.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.845 0.355 . . . . 0.0 110.925 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -79.99 130.48 35.31 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 175.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.622 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 10.6 t60 -125.64 77.47 1.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.188 0.518 . . . . 0.0 109.613 -173.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 5.0 t -87.2 114.23 23.63 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.543 0.687 . . . . 0.0 109.319 175.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.706 ' OE2' ' HA3' ' A' ' 137' ' ' GLY . 5.6 tp10 -82.17 41.32 0.67 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.616 0.722 . . . . 0.0 109.378 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -143.06 -75.79 0.26 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.375 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -118.42 95.35 4.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.068 -174.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.35 86.08 2.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.165 -177.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.45 ' C ' ' H ' ' A' ' 134' ' ' GLY . 28.7 t80 -151.08 122.06 7.65 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.591 ' O ' ' HB3' ' A' ' 145' ' ' LEU . 71.3 m95 74.73 -10.34 1.2 Allowed 'General case' 0 N--CA 1.474 0.737 0 O-C-N 124.016 0.823 . . . . 0.0 110.585 -171.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.563 ' O ' ' HA3' ' A' ' 141' ' ' GLY . . . -137.79 136.99 8.54 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 108.196 -1.962 . . . . 0.0 108.196 176.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 143' ' ' ASN . 1.4 t70 -68.82 1.77 3.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.697 0.749 . . . . 0.0 112.109 -166.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 68.85 -164.53 49.32 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.933 175.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.706 ' HA3' ' OE2' ' A' ' 128' ' ' GLU . . . -89.98 -17.02 55.13 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.924 178.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -99.63 -16.92 18.05 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 89.08 62.07 1.38 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.118 -1.039 . . . . 0.0 112.468 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 56.4 tttm 176.84 65.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 176.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.563 ' HA3' ' O ' ' A' ' 134' ' ' GLY . . . -124.67 4.62 8.61 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.176 -1.012 . . . . 0.0 113.441 -173.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.485 ' C ' ' H ' ' A' ' 144' ' ' ARG . 55.0 mttp 64.19 53.71 1.73 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.122 0.486 . . . . 0.0 109.895 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.56 ' HB2' ' HB2' ' A' ' 135' ' ' ASP . 7.4 t30 -57.15 5.1 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.368 1.467 . . . . 0.0 113.791 -177.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.519 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 57.9 mtm180 -51.84 -13.28 0.26 Allowed 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.591 ' HB3' ' O ' ' A' ' 133' ' ' TRP . 25.4 tp -60.57 -49.84 75.94 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 171.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.637 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -62.92 -33.03 85.98 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.555 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -68.82 -41.21 78.93 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 121.165 -0.214 . . . . 0.0 110.638 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 88.7 mt -58.05 -37.13 73.82 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.83 -38.07 89.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.914 175.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.637 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 38.5 mtt -66.35 -50.28 64.08 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.183 0.516 . . . . 0.0 110.189 178.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.489 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 23.0 tt0 -69.38 -35.95 76.31 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.608 -176.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 102' ' ' ARG . 50.9 tp -62.07 -43.92 97.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.041 0.448 . . . . 0.0 109.859 174.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.518 ' HD2' ' HB1' ' A' ' 119' ' ' ALA . 47.5 ttp85 -55.51 -41.54 73.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.969 176.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.5 ' O ' HG13 ' A' ' 158' ' ' ILE . 31.6 tt0 -68.36 -34.71 76.57 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.684 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 151' ' ' GLU . 15.3 mt-30 -65.35 -41.85 93.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.068 0.461 . . . . 0.0 109.858 176.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.574 HD11 ' HG3' ' A' ' 112' ' ' ARG . 94.3 mt -67.27 -28.88 68.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.086 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -69.44 -40.95 76.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.453 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 154' ' ' GLU . 76.2 mt -60.63 -46.06 96.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.669 0.271 . . . . 0.0 110.474 178.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . 0.481 ' CD ' HH22 ' A' ' 112' ' ' ARG . 0.2 OUTLIER -61.3 -38.45 86.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.07 0.462 . . . . 0.0 110.088 177.381 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -70.33 -33.31 71.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.477 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 4.6 mp -68.63 -10.62 57.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.132 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -83.7 10.26 9.74 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.426 174.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -53.81 106.7 0.2 Allowed 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 121.692 0.758 . . . . 0.0 111.952 176.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -154.8 86.36 1.12 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 176.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.01 143.47 29.47 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.072 -174.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -79.15 75.83 5.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.117 -176.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 33.9 m-70 -160.08 -39.65 0.05 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.218 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 . . . . . 0 C--O 1.244 0.78 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.083 179.775 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 ptt? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -84.58 105.57 1.03 Allowed 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 122.785 2.324 . . . . 0.0 112.85 -177.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.707 HG22 ' H ' ' A' ' 5' ' ' ALA . 2.5 p -137.95 -65.93 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.926 177.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.647 ' H ' HG13 ' A' ' 3' ' ' VAL . 7.2 tpp85 56.84 25.73 10.73 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.74 0.781 . . . . 0.0 111.586 178.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.707 ' H ' HG22 ' A' ' 3' ' ' VAL . . . -69.32 127.87 34.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 173.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -66.2 -41.81 89.66 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.946 -176.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 64.82 171.1 0.2 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.505 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 25.8 pt -135.85 150.68 28.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.762 175.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -72.91 -38.75 66.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.111 0.481 . . . . 0.0 110.169 177.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.8 p-80 -165.34 171.55 13.34 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.89 179.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.689 HG23 ' HD2' ' A' ' 120' ' ' PRO . 34.1 m -93.74 175.19 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 174.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 51.4 mtm -108.95 37.22 2.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.312 -178.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 63.83 102.56 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.952 -178.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.3 t70 49.95 79.84 0.08 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.528 -175.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.8 m -103.66 127.41 51.1 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.713 -178.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 48.5 mt -96.67 107.13 19.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 CA-C-O 121.446 0.641 . . . . 0.0 110.074 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -89.89 96.96 6.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.24 -176.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.503 HD21 ' HB ' ' A' ' 124' ' ' VAL . 12.7 m120 -83.51 101.34 11.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.362 174.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 125' ' ' GLU . 52.5 p90 -116.19 148.93 39.89 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.781 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 126' ' ' HIS . 34.9 t80 -150.23 150.3 31.38 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.388 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 96.1 p 62.48 159.52 0.07 Allowed 'General case' 0 C--O 1.231 0.113 0 O-C-N 124.867 1.354 . . . . 0.0 111.661 177.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.471 HG23 ' HA ' ' A' ' 33' ' ' ALA . 7.8 p -83.14 -65.99 0.94 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.528 175.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.1 t 61.41 -78.88 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.205 0 O-C-N 124.135 0.897 . . . . 0.0 111.625 176.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -105.9 -169.08 1.53 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.901 0.381 . . . . 0.0 110.117 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -66.02 -31.93 73.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.749 -174.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -75.99 -1.59 26.44 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.309 0.576 . . . . 0.0 111.187 -175.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.46 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -68.53 -0.32 16.93 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.109 174.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -52.36 -32.47 38.55 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.602 0.761 . . . . 0.0 112.642 -177.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -60.1 -36.49 77.53 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.7 t -59.97 148.86 33.74 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.133 0.492 . . . . 0.0 111.04 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -74.5 -14.64 60.84 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.096 0.474 . . . . 0.0 109.928 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -96.84 7.9 45.57 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.31 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.471 ' HA ' HG23 ' A' ' 22' ' ' THR . . . -70.69 136.06 48.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.715 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -83.12 64.6 7.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.608 0.718 . . . . 0.0 110.939 -174.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.405 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 70.4 m95 -108.86 120.97 44.46 Favored Pre-proline 0 C--N 1.314 -0.957 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.048 172.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 34.5 Cg_exo -60.49 133.45 48.97 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.985 2.457 . . . . 0.0 112.518 -177.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.469 HD11 ' HA ' ' A' ' 47' ' ' SER . 39.0 pt -118.81 147.91 22.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.967 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -109.04 98.62 8.06 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.401 ' CG1' ' HE2' ' A' ' 99' ' ' LYS . 21.2 t -122.02 120.37 61.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.913 -174.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 61.57 27.8 17.19 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.593 0.558 . . . . 0.0 110.629 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.39 0.57 90.12 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 121.034 -0.603 . . . . 0.0 112.462 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -104.63 144.4 31.76 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -177.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.1 m -105.29 109.07 20.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.924 0.392 . . . . 0.0 110.674 -175.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -102.05 143.84 27.41 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.713 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.24 -30.48 93.07 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.939 2.426 . . . . 0.0 112.248 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.733 HG23 ' OE1' ' A' ' 48' ' ' GLU . 2.3 t -170.76 -179.93 3.01 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.882 177.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.469 ' HA ' HD11 ' A' ' 37' ' ' ILE . 20.3 m -66.62 -39.62 88.41 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 113.369 0.878 . . . . 0.0 113.369 -166.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.733 ' OE1' HG23 ' A' ' 46' ' ' THR . 0.6 OUTLIER -63.15 -33.99 76.65 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.498 -171.954 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -56.01 -42.99 77.3 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.609 0.242 . . . . 0.0 111.072 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -71.46 -39.63 70.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.99 0.424 . . . . 0.0 110.24 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -60.63 -38.37 84.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.151 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.1 mm100 -72.87 -46.47 52.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.424 177.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.663 ' HB3' ' HG3' ' A' ' 62' ' ' ARG . . . -61.4 -42.18 98.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.705 -179.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -84.8 -13.66 50.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.764 -176.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.823 ' HZ1' ' HB2' ' A' ' 55' ' ' LYS . 4.8 ttmp? -64.35 -53.14 53.31 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.86 0.362 . . . . 0.0 110.612 173.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.436 ' HE1' ' HB2' ' A' ' 83' ' ' LYS . 92.9 m-85 -80.66 160.22 25.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.12 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.456 HD13 ' HB3' ' A' ' 86' ' ' ARG . 5.5 mp -98.89 -28.84 13.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.645 177.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -58.85 120.57 9.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.06 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -68.72 -37.45 79.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -61.27 -42.74 99.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.417 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.417 ' O ' HG13 ' A' ' 65' ' ' ILE . 0.2 OUTLIER -74.14 -37.28 64.09 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.68 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.663 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 40.5 ttm180 -62.58 -41.56 99.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.397 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.527 ' HG2' ' NH1' ' A' ' 67' ' ' ARG . 16.5 tt0 -71.04 -26.93 63.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.025 178.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -68.09 -40.46 82.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.851 175.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.495 HG12 ' SD ' ' A' ' 77' ' ' MET . 56.6 mt -71.89 -18.52 19.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.283 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -75.38 -24.65 57.27 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.527 ' NH1' ' HG2' ' A' ' 63' ' ' GLU . 35.8 mmt-85 -73.37 -36.08 66.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.999 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.449 HG23 ' HB ' ' A' ' 73' ' ' VAL . 14.9 p -75.39 125.39 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.638 0.733 . . . . 0.0 112.038 -171.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.2 p -91.4 -38.78 12.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.392 176.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 20.0 m -72.57 121.04 83.84 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.513 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -52.52 -46.29 34.23 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.658 2.906 . . . . 0.0 113.519 179.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 85.1 mtp -63.81 -31.36 72.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.322 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.449 ' HB ' HG23 ' A' ' 68' ' ' VAL . 43.2 t -75.98 -32.29 23.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.808 0.337 . . . . 0.0 110.244 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.62 99.51 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.265 0.555 . . . . 0.0 110.462 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.23 -39.51 86.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.09 175.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -34.62 72.03 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.899 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.495 ' SD ' HG12 ' A' ' 65' ' ' ILE . 64.2 mtt -64.73 -55.04 22.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.061 0.458 . . . . 0.0 110.653 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.22 11.59 60.37 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.047 -0.597 . . . . 0.0 113.007 -176.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.54 -15.73 63.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.074 0.464 . . . . 0.0 110.372 174.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -107.18 114.03 27.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.439 177.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.618 ' HB2' HD12 ' A' ' 85' ' ' LEU . 26.1 ptt180 -101.16 24.93 8.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.783 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.4 m -81.08 -9.96 59.74 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.662 0.744 . . . . 0.0 109.223 174.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.436 ' HB2' ' HE1' ' A' ' 56' ' ' PHE . 46.8 mmtm -80.59 166.29 40.5 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.864 177.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -56.31 108.36 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.466 2.111 . . . . 0.0 113.126 -177.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.618 HD12 ' HB2' ' A' ' 81' ' ' ARG . 92.7 mt -91.8 148.85 21.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.824 175.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.456 ' HB3' HD13 ' A' ' 57' ' ' LEU . 11.6 ptp180 -84.26 150.01 25.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.04 0.448 . . . . 0.0 111.519 -175.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -75.27 -25.45 58.02 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.997 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -90.92 9.94 28.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.835 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.416 ' HB2' ' HG3' ' A' ' 86' ' ' ARG . 58.0 t-105 -56.27 -47.6 78.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.756 -174.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.4 -16.52 64.15 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -177.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.4 m -99.6 -30.45 12.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.89 0.376 . . . . 0.0 111.285 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 29.7 m -93.0 -0.08 10.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.668 0.27 . . . . 0.0 110.7 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.483 ' HB3' ' HZ1' ' A' ' 93' ' ' LYS . 7.0 ttpm? -55.39 -57.95 9.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.195 0.522 . . . . 0.0 110.554 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -64.63 -40.62 95.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.984 177.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.49 -53.65 48.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.566 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 45.1 t -60.18 -49.27 84.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.072 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.1 tpt -65.94 -38.91 89.83 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.908 -174.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.504 ' HD3' HD22 ' A' ' 148' ' ' LEU . 31.8 mtm180 -73.5 -22.63 60.09 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.444 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.401 ' HE2' ' CG1' ' A' ' 39' ' ' VAL . 86.9 tttt -72.97 -38.37 66.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.015 0.436 . . . . 0.0 109.858 176.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.77 -42.38 67.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.473 176.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.453 HD21 HD22 ' A' ' 149' ' ' LEU . 61.7 mt -63.13 -42.98 99.6 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.008 177.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 102' ' ' ARG . 40.7 ttm180 -52.35 -53.0 50.3 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.768 175.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.416 ' CB ' ' HB ' ' A' ' 37' ' ' ILE . . . -55.36 -43.62 75.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.002 -176.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -63.0 -52.14 64.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.685 0.279 . . . . 0.0 111.013 -176.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -77.37 -28.59 52.93 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -79.64 -46.21 17.62 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 122.248 -0.282 . . . . 0.0 111.15 -175.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -66.58 -38.95 88.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.88 0.371 . . . . 0.0 110.767 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -101.96 100.27 10.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.437 178.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.92 -22.64 65.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.106 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.48 -49.58 74.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.909 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 51.3 mt -74.71 -33.93 62.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.953 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.4 ttt180 -54.35 -51.14 65.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.274 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.7 -36.61 80.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.873 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.3 tp -65.23 -41.01 94.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.579 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.73 ' HG ' ' HB2' ' A' ' 153' ' ' ARG . 47.2 tp -63.78 -33.65 76.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.539 177.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.3 mt -81.19 -14.98 57.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.148 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.91 -30.51 21.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.182 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 18.1 p -72.36 -25.92 61.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.152 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.419 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -40.67 132.62 1.75 Allowed Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.147 173.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . 0.689 ' HD2' HG23 ' A' ' 11' ' ' VAL . 28.2 Cg_endo -101.15 31.27 10.14 Favored 'Cis proline' 0 N--CA 1.459 -0.528 0 C-N-CA 124.702 -0.957 . . . . 0.0 112.807 -1.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -60.01 141.84 54.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.902 0.382 . . . . 0.0 111.658 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.5 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 17.3 ttpt -84.62 113.89 21.59 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.98 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 41.5 mt -81.47 116.88 21.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.776 -175.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.503 ' HB ' HD21 ' A' ' 18' ' ' ASN . 89.1 t -128.88 116.72 42.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.732 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.439 ' HA ' ' O ' ' A' ' 19' ' ' PHE . 37.0 tt0 -88.13 128.39 35.43 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.485 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 8.0 t60 -97.05 77.2 2.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.488 0.661 . . . . 0.0 110.223 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.4 m -104.49 101.02 10.7 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.94 -177.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.405 ' HG3' ' HA3' ' A' ' 137' ' ' GLY . 34.9 tt0 -84.98 -43.48 13.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.556 -173.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -62.68 -52.88 61.55 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -103.68 100.56 10.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.519 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.489 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -77.74 85.52 4.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.967 0.413 . . . . 0.0 110.391 178.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.403 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 5.4 t80 -170.03 118.79 0.59 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.685 ' HB3' HD21 ' A' ' 145' ' ' LEU . 3.7 m95 71.37 10.6 6.64 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.782 0.676 . . . . 0.0 111.571 -178.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -136.45 -153.89 6.65 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.389 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.485 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 2.1 p-10 -91.52 -13.54 31.95 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.345 0.593 . . . . 0.0 109.846 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.489 ' HA2' ' HA ' ' A' ' 131' ' ' ALA . . . 77.06 -0.15 67.99 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.171 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.405 ' HA3' ' HG3' ' A' ' 128' ' ' GLU . . . 81.25 15.93 75.48 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.361 -0.447 . . . . 0.0 112.719 -177.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -168.1 -24.79 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -177.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 141.49 -49.65 0.76 Allowed Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.256 -0.973 . . . . 0.0 112.499 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -82.94 62.76 6.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.33 0.586 . . . . 0.0 110.126 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.18 8.62 9.03 Favored Glycine 0 C--N 1.315 -0.616 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.787 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 49.9 mttp 62.48 63.67 1.0 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 122.509 0.323 . . . . 0.0 111.228 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.419 ' OD1' HG11 ' A' ' 124' ' ' VAL . 6.4 t30 -72.66 5.16 3.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.96 0.41 . . . . 0.0 111.304 -177.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.623 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 44.7 ttm180 -47.6 -25.91 1.3 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.761 177.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.685 HD21 ' HB3' ' A' ' 133' ' ' TRP . 20.4 tp -53.9 -47.17 71.43 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.857 0.36 . . . . 0.0 110.391 175.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -62.93 -36.05 92.89 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.96 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . 0.47 ' HA ' ' HE3' ' A' ' 150' ' ' MET . 86.4 t80 -67.08 -41.3 86.57 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 176.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 82.1 mt -61.1 -40.23 92.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.235 -0.439 . . . . 0.0 109.93 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.453 HD22 HD21 ' A' ' 101' ' ' LEU . 96.1 mt -60.06 -46.86 88.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.53 174.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.5 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 74.2 mtm -67.5 -39.54 85.17 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.798 -178.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -70.71 -35.62 72.84 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.529 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 54.9 tp -61.95 -45.77 92.24 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 173.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.73 ' HB2' ' HG ' ' A' ' 115' ' ' LEU . 0.6 OUTLIER -52.01 -42.46 63.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.877 175.461 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -62.03 -38.24 87.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.732 -177.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -73.48 -38.72 65.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.845 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 41.0 mt -67.09 -23.28 65.83 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.084 0.468 . . . . 0.0 110.715 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.32 72.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.218 173.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.56 -33.54 64.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.699 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.25 -49.65 63.63 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.36 0.6 . . . . 0.0 110.97 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 13.7 mttp -87.06 -20.83 26.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.296 -176.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 11.5 tp -63.7 -27.9 69.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.34 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.01 6.56 0.5 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.803 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -60.79 -24.1 65.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.598 175.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -70.57 108.05 4.16 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 170.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -113.9 98.61 7.11 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.805 0.812 . . . . 0.0 112.907 -167.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 21.3 t60 -128.06 27.65 5.64 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 166.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -87.55 65.64 8.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.757 -1.11 . . . . 0.0 109.575 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 . . . . . 0 C--O 1.249 1.056 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.567 -177.364 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.41 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 23.8 mmt . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 1' ' ' MET . 5.0 Cg_exo -78.81 101.49 1.45 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.793 2.329 . . . . 0.0 111.739 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -129.58 -35.62 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.564 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 65.89 -81.13 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.957 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 61.1 90.77 0.06 Allowed 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.946 0.779 . . . . 0.0 111.919 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.487 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 12.5 mm-40 -66.77 108.97 2.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.336 0.589 . . . . 0.0 111.127 176.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -83.76 112.98 20.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.014 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.3 tt -76.23 -26.38 17.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.001 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 62.85 80.75 0.22 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.785 -177.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 66.67 -179.53 0.21 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.434 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.469 HG13 ' HB2' ' A' ' 121' ' ' ALA . 28.3 m -129.25 -174.41 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.631 173.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.2 mmt -93.71 -74.26 0.54 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.17 0.509 . . . . 0.0 110.463 -173.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -176.48 121.83 0.15 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.929 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.6 t70 54.33 39.95 31.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.792 0.806 . . . . 0.0 110.055 -176.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.4 m -76.31 140.66 41.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.139 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.406 HG12 ' HB3' ' A' ' 122' ' ' LYS . 61.2 mt -115.62 121.51 67.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.4 mt -103.88 111.0 31.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.001 -175.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.607 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 8.5 m120 -87.88 101.34 13.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.968 173.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.49 ' CD1' ' HB2' ' A' ' 29' ' ' PHE . 42.6 p90 -101.24 128.54 47.31 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.996 0.426 . . . . 0.0 110.962 -178.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -150.57 -179.19 7.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 173.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.0 m 71.3 84.82 0.13 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.638 0.732 . . . . 0.0 110.658 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.92 -9.82 58.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.233 -175.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.5 m -99.4 3.02 45.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.737 0.304 . . . . 0.0 110.855 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -93.35 -84.83 0.29 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.339 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -171.81 -46.6 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.595 0.236 . . . . 0.0 111.072 174.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -84.18 -4.8 59.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.366 0.603 . . . . 0.0 110.605 -174.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -79.13 -0.3 82.17 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.734 -0.667 . . . . 0.0 112.274 177.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -51.28 -33.5 28.88 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -177.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.49 ' HB2' ' CD1' ' A' ' 19' ' ' PHE . 89.0 m-85 -56.98 -19.07 16.12 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -176.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.3 t -75.45 147.71 39.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.197 0.522 . . . . 0.0 110.45 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -73.27 -10.03 59.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.214 -176.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -90.15 8.35 33.36 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.408 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.35 139.22 55.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.163 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.504 ' HA ' HG21 ' A' ' 46' ' ' THR . . . -82.67 57.35 3.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.599 -176.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.428 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 76.1 m95 -118.32 115.92 35.74 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.493 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 35' ' ' TRP . 19.4 Cg_endo -60.48 136.61 68.68 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.996 2.464 . . . . 0.0 112.386 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.545 HG22 ' HA ' ' A' ' 104' ' ' LYS . 24.4 pt -123.8 176.43 5.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.053 -178.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 42.2 tptt -131.4 100.37 5.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.3 t -119.01 130.06 74.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.936 -174.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 62.8 9.52 3.69 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 124.044 0.84 . . . . 0.0 111.362 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.94 4.02 42.11 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.82 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -120.21 146.17 46.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 117.188 0.494 . . . . 0.0 110.952 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.1 m -79.17 131.67 36.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.303 176.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.425 ' HB2' HG13 ' A' ' 37' ' ' ILE . 86.8 m95 -122.46 137.26 27.48 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 176.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.44 -36.55 98.76 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.672 2.248 . . . . 0.0 112.437 -178.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.504 HG21 ' HA ' ' A' ' 34' ' ' ALA . 81.0 p -148.18 174.16 12.26 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.3 m -72.85 -28.42 62.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.307 0.575 . . . . 0.0 109.913 174.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.527 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -68.47 -36.09 78.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.256 -179.706 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.436 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 34.4 m80 -62.37 -36.39 82.12 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.407 0.146 . . . . 0.0 111.31 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -72.57 -37.85 68.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.014 0.435 . . . . 0.0 109.952 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -62.42 -47.62 83.28 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.726 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.569 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 64.6 mm-40 -64.72 -44.88 88.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.363 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.424 ' HB3' ' HG3' ' A' ' 62' ' ' ARG . . . -60.41 -36.54 78.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.305 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -71.26 -29.4 65.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.573 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.6 ' HB2' ' CZ2' ' A' ' 89' ' ' TRP . 75.3 tttt -65.37 -43.64 90.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.787 176.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.73 ' HE1' ' HG3' ' A' ' 83' ' ' LYS . 75.5 m-85 -73.64 109.85 7.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.752 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.497 HD13 ' HB3' ' A' ' 86' ' ' ARG . 11.2 mp -85.3 34.6 0.57 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.811 0.815 . . . . 0.0 108.983 168.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.46 ' H ' ' C ' ' A' ' 56' ' ' PHE . 9.9 t0 -116.59 111.02 19.3 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.387 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -55.08 -56.14 23.2 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -171.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' A' ' 60' ' ' LYS . 4.3 mptp? -72.4 -26.39 61.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.603 0.239 . . . . 0.0 111.489 -176.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.549 ' O ' HG12 ' A' ' 65' ' ' ILE . 0.4 OUTLIER -74.5 -37.93 62.99 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 178.044 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.424 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 40.0 ttm180 -61.76 -40.78 96.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.182 0.515 . . . . 0.0 109.958 175.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.39 -39.7 94.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.723 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -64.2 -37.87 89.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.547 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 61' ' ' TYR . 44.5 mm -65.42 -35.2 74.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.863 0.363 . . . . 0.0 111.042 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.04 -22.45 52.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.268 0.556 . . . . 0.0 109.562 176.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -79.11 -18.8 52.61 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.417 -176.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.9 m -93.76 131.12 41.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.345 0.593 . . . . 0.0 110.726 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.2 p -88.0 -18.88 28.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.287 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.402 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 42.0 t -80.89 124.49 81.48 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.928 -177.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.436 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 18.5 Cg_exo -68.15 -39.81 9.83 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.236 2.624 . . . . 0.0 111.992 177.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.9 tpt -65.57 -35.35 80.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.757 -176.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.642 ' O ' ' HG2' ' A' ' 77' ' ' MET . 92.8 t -66.98 -44.15 88.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.392 178.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.39 -40.03 85.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.947 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.77 -37.79 85.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.8 0.334 . . . . 0.0 110.429 175.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -64.13 -37.9 89.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.302 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.642 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 6.7 mmt -60.31 -57.13 14.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.5 0.667 . . . . 0.0 109.973 176.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.569 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -80.5 3.08 75.35 Favored Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.121 -0.945 . . . . 0.0 113.346 -174.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -80.2 -19.54 46.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 117.088 0.444 . . . . 0.0 110.1 175.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -79.08 172.56 13.64 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.894 0.378 . . . . 0.0 110.001 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -134.14 1.69 3.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.949 0.404 . . . . 0.0 110.321 -176.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.6 p -88.24 -5.16 58.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.96 0.41 . . . . 0.0 111.58 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.794 ' HE3' ' HD2' ' A' ' 84' ' ' PRO . 30.4 mmmt -89.96 151.54 45.34 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.751 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.794 ' HD2' ' HE3' ' A' ' 83' ' ' LYS . 18.9 Cg_endo -57.19 119.01 5.99 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.286 2.658 . . . . 0.0 113.182 -177.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.578 HD23 ' HE3' ' A' ' 55' ' ' LYS . 57.8 mt -107.18 169.02 8.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.186 178.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.535 ' HG2' ' HB2' ' A' ' 89' ' ' TRP . 12.7 ptm180 -100.28 175.95 5.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.822 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -60.11 -69.31 0.22 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.253 -171.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -97.38 36.38 1.48 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.792 0.33 . . . . 0.0 111.108 -176.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.6 ' CZ2' ' HB2' ' A' ' 55' ' ' LYS . 33.3 t-105 -58.66 -35.13 72.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.859 0.361 . . . . 0.0 111.75 -178.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -73.5 -16.99 61.27 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.295 -177.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.9 m -99.69 -37.54 9.07 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.877 0.37 . . . . 0.0 111.282 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m -85.81 3.01 4.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -172.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 59.0 mttp -55.11 -46.49 75.57 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.061 0.458 . . . . 0.0 111.5 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.406 ' H ' ' HG2' ' A' ' 94' ' ' GLU . 3.9 pt-20 -68.06 -25.43 65.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.348 -177.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -75.03 -43.81 51.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.906 0.384 . . . . 0.0 110.117 176.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.16 -47.33 94.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.643 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.8 mtt -65.94 -32.94 74.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.492 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.664 HH21 HD23 ' A' ' 148' ' ' LEU . 27.7 ttm180 -60.87 -43.87 97.82 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.842 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -69.51 -40.49 76.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.76 0.314 . . . . 0.0 110.543 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.1 -47.64 76.48 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.412 HD12 HD23 ' A' ' 149' ' ' LEU . 69.9 mt -66.8 -37.04 83.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.291 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.512 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 52.1 ttt180 -60.21 -48.78 80.3 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.826 177.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.556 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -58.52 -30.43 67.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.889 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.545 ' HA ' HG22 ' A' ' 37' ' ' ILE . 55.9 tttt -66.05 -55.0 18.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.16 177.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -74.9 -10.87 59.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.099 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.512 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 60.3 mt-10 -88.3 -27.79 21.48 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.885 0.374 . . . . 0.0 110.395 172.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.556 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 1.3 tp-100 -86.42 -30.82 21.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.732 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -115.24 111.75 21.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.664 0.269 . . . . 0.0 110.818 -177.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.02 -39.35 91.99 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.974 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -53.38 -47.53 69.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.081 0.467 . . . . 0.0 110.93 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.439 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 22.3 mt -74.95 -31.16 61.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.439 -176.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.505 HH21 ' HA ' ' A' ' 106' ' ' GLU . 6.7 tpp180 -56.92 -50.45 72.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.529 176.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.99 -38.62 76.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.895 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 60.2 tp -60.3 -45.17 94.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 35.0 tp -62.08 -44.48 96.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.086 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.501 HD22 ' HB2' ' A' ' 156' ' ' LEU . 38.6 mt -74.72 -18.17 60.54 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.66 0.267 . . . . 0.0 111.21 -177.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.95 -23.22 52.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.446 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 57.9 p -71.88 -24.64 61.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.883 0.373 . . . . 0.0 110.931 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -47.84 136.47 10.62 Favored Pre-proline 0 C--O 1.234 0.25 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.891 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -100.78 33.3 8.6 Favored 'Cis proline' 0 CA--C 1.534 0.511 0 C-N-CA 124.26 -1.142 . . . . 0.0 113.641 -1.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.469 ' HB2' HG13 ' A' ' 11' ' ' VAL . . . -67.53 159.06 30.5 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -175.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.406 ' HB3' HG12 ' A' ' 16' ' ' ILE . 44.3 tttp -88.27 121.33 30.54 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.759 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.0 mt -90.09 114.34 26.24 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.787 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.607 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 61.6 t -129.61 114.96 32.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.625 -0.262 . . . . 0.0 111.118 -178.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -74.18 118.53 17.24 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.504 ' HA ' ' HB2' ' A' ' 135' ' ' ASP . 80.8 t60 -85.53 77.51 9.85 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.865 -0.734 . . . . 0.0 109.188 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.51 107.31 9.87 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.633 178.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -106.61 15.93 25.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.553 0.692 . . . . 0.0 110.404 -175.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -125.98 -25.04 3.65 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.371 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -131.86 136.78 47.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.49 176.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.488 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -99.9 85.81 3.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.34 0.591 . . . . 0.0 109.843 173.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.441 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 5.6 t80 178.07 140.32 0.09 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.006 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.734 ' HB3' HD22 ' A' ' 145' ' ' LEU . 12.2 m95 74.93 6.29 4.33 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.872 0.732 . . . . 0.0 112.089 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -172.3 -113.85 0.31 Allowed Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 118.572 -1.775 . . . . 0.0 114.369 -178.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.504 ' HB2' ' HA ' ' A' ' 126' ' ' HIS . 9.8 t70 -98.57 -49.42 4.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.068 -0.566 . . . . 0.0 112.007 -167.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.488 ' HA2' ' HA ' ' A' ' 131' ' ' ALA . . . 82.6 -6.22 70.41 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.981 -177.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 94.2 16.95 41.86 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.586 -0.606 . . . . 0.0 111.586 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 20.4 p80 -168.6 24.91 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.501 -0.35 . . . . 0.0 111.005 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 79.08 -46.29 2.93 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.389 -0.434 . . . . 0.0 113.891 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -88.25 68.18 8.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.126 0.965 . . . . 0.0 110.67 -173.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -122.87 15.42 8.38 Favored Glycine 0 C--N 1.311 -0.82 0 CA-C-N 114.002 -1.454 . . . . 0.0 111.86 177.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.409 ' C ' ' H ' ' A' ' 144' ' ' ARG . 45.9 mttt 72.55 80.87 0.14 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.492 0.663 . . . . 0.0 111.36 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -67.49 4.79 0.93 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.741 -1.118 . . . . 0.0 111.774 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.711 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 12.3 ttp180 -58.22 -22.1 50.61 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.866 -0.521 . . . . 0.0 112.239 -175.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.734 HD22 ' HB3' ' A' ' 133' ' ' TRP . 41.8 tp -66.08 -48.47 70.86 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 174.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -64.46 -28.9 73.77 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 174.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . 0.488 ' HA ' ' HE2' ' A' ' 150' ' ' MET . 31.4 t80 -68.83 -37.31 79.08 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 175.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.711 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 79.7 mt -58.85 -47.61 84.27 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 172.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.412 HD23 HD12 ' A' ' 101' ' ' LEU . 96.0 mt -61.77 -38.5 88.23 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.866 178.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.488 ' HE2' ' HA ' ' A' ' 147' ' ' TYR . 72.4 mtm -72.11 -40.16 68.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.656 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -67.19 -38.66 85.75 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.121 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.527 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 61.3 tp -62.32 -46.21 89.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.687 174.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 2.8 ttp-105 -52.23 -44.99 65.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.644 175.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -67.44 -38.83 85.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.6 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -72.61 -35.62 67.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.903 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 76.5 mt -74.78 -23.54 58.53 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 176.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.4 -25.16 61.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.441 175.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.73 -39.75 82.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 175.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -63.34 -38.54 91.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.341 174.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -63.88 -41.1 97.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.23 176.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.4 -46.26 73.78 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.423 178.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -84.53 11.31 8.96 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -66.66 139.37 57.85 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 32.2 t-80 164.99 -41.42 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -170.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -139.55 31.14 2.09 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.636 176.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.444 ' O ' ' HB2' ' A' ' 167' ' ' HIS . 1.7 m-70 -111.07 75.22 0.91 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' A' ' 166' ' ' HIS . 74.5 m80 73.44 -43.7 0.56 Allowed 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.978 0.799 . . . . 0.0 109.137 -167.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.427 ' H ' ' C ' ' A' ' 166' ' ' HIS . 28.8 p-80 . . . . . 0 C--O 1.249 1.061 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 168.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.5 mtm . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -78.24 -167.5 0.5 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 122.647 2.231 . . . . 0.0 112.215 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 37.6 t -84.83 85.82 2.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.297 0.57 . . . . 0.0 110.312 -179.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -107.42 29.8 6.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.314 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.85 76.75 1.15 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.142 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -151.53 118.17 5.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.577 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -165.34 -33.83 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.545 175.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 65.8 mt -87.69 108.37 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.601 176.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -62.1 -61.81 2.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.652 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -172.59 127.04 0.51 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.971 -1.013 . . . . 0.0 108.556 176.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.4 m -70.99 151.38 9.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.966 0.413 . . . . 0.0 110.556 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.477 ' HG2' ' OG1' ' A' ' 15' ' ' THR . 0.0 OUTLIER -75.35 -66.66 0.74 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.234 -178.617 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' A' ' 12' ' ' MET . 58.3 tt0 174.51 -39.11 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.164 -0.925 . . . . 0.0 109.047 176.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -82.78 12.28 4.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.431 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.515 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 18.0 m -82.44 138.75 34.31 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.576 -174.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.625 HG12 ' HE3' ' A' ' 122' ' ' LYS . 61.2 mt -124.81 120.81 59.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.201 174.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.2 mp -89.98 101.22 12.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.633 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 18.7 m120 -91.77 101.06 13.66 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 176.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.405 ' HB2' ' CB ' ' A' ' 26' ' ' TYR . 37.1 p90 -107.38 174.82 5.72 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.344 -174.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.57 -179.26 5.58 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.266 -177.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.466 ' HA ' ' OG ' ' A' ' 30' ' ' SER . 17.2 m -64.51 -173.51 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.84 0.713 . . . . 0.0 112.356 -176.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.66 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 34.2 p -67.34 2.69 1.55 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -169.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.4 t -92.93 12.06 25.15 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.372 0.606 . . . . 0.0 109.801 176.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -129.22 166.63 19.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.172 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -61.55 -35.29 77.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.893 0.378 . . . . 0.0 110.668 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.405 ' CB ' ' HB2' ' A' ' 19' ' ' PHE . 98.8 m-85 -80.76 -1.42 42.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.954 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.66 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -57.03 -23.0 44.69 Favored Glycine 0 CA--C 1.52 0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 114.408 -174.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -69.44 -14.19 62.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 117.524 0.662 . . . . 0.0 111.27 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -73.44 -38.92 65.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.801 -0.181 . . . . 0.0 110.851 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.466 ' OG ' ' HA ' ' A' ' 21' ' ' SER . 64.6 m -59.27 158.84 8.51 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.674 0.749 . . . . 0.0 112.964 -173.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -69.96 -19.82 63.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.549 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.605 ' CE1' ' HB2' ' A' ' 71' ' ' PRO . 13.0 t80 -92.54 7.24 44.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.542 -176.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.52 129.0 37.3 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.593 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.502 ' HA ' HG21 ' A' ' 46' ' ' THR . . . -80.17 60.39 3.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.255 0.55 . . . . 0.0 111.387 -175.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 58.5 m95 -111.16 112.43 55.15 Favored Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.388 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.422 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 42.2 Cg_exo -57.13 126.91 23.65 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 123.183 2.589 . . . . 0.0 113.237 -175.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.498 ' CG1' ' HB2' ' A' ' 44' ' ' TRP . 37.6 pt -103.33 145.2 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.49 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.5 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 14.9 tptm -108.39 92.59 4.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.957 0.408 . . . . 0.0 109.901 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 26.1 t -121.33 128.25 75.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.136 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.7 t70 66.8 16.91 10.49 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.811 0.815 . . . . 0.0 110.255 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.9 10.97 83.34 Favored Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.703 -176.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 57.6 mttp -111.01 143.26 41.98 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 56.8 m -94.48 113.28 25.1 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.534 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.498 ' HB2' ' CG1' ' A' ' 37' ' ' ILE . 62.4 m95 -104.31 126.0 32.72 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 176.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 23.3 Cg_exo -62.91 -13.63 36.01 Favored 'Trans proline' 0 N--CA 1.473 0.281 0 C-N-CA 123.177 2.585 . . . . 0.0 113.059 -175.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.502 HG21 ' HA ' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -164.91 151.8 10.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.069 -178.256 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.9 m -58.53 -34.1 70.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.102 0.477 . . . . 0.0 109.954 175.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 51' ' ' PHE . 15.9 tm-20 -54.1 -42.97 69.98 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.311 177.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -69.54 -37.19 76.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.6 -175.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.468 ' CE2' HG12 ' A' ' 96' ' ' VAL . 90.8 t80 -69.91 -35.95 75.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 176.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.477 ' CZ ' ' HZ2' ' A' ' 89' ' ' TRP . 68.6 t80 -56.29 -52.51 64.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.761 177.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.624 ' NE2' ' HA ' ' A' ' 75' ' ' ALA . 17.1 mm-40 -66.81 -50.11 63.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.134 -178.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.513 ' HB3' ' HG3' ' A' ' 62' ' ' ARG . . . -58.51 -30.47 67.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.353 -177.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.477 ' HA ' HE21 ' A' ' 54' ' ' GLN . 0.0 OUTLIER -78.4 -42.92 28.82 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.154 178.216 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.521 ' HG2' HD23 ' A' ' 85' ' ' LEU . 27.3 ttpp -57.06 -39.65 75.32 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.158 -177.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -92.46 139.77 30.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.401 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.755 ' H ' HD22 ' A' ' 57' ' ' LEU . 1.5 pt? -113.45 18.4 17.73 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.371 0.605 . . . . 0.0 110.275 -178.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -96.11 128.25 42.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.631 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -60.75 -48.01 83.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.463 -177.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -59.12 -46.38 88.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.701 0.286 . . . . 0.0 111.498 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.525 ' CZ ' ' HE3' ' A' ' 83' ' ' LYS . 2.5 t80 -74.39 -32.59 62.78 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.01 -174.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.513 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 41.7 ttm180 -64.88 -35.32 80.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.226 0.536 . . . . 0.0 109.618 174.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.496 ' HG2' ' HD3' ' A' ' 67' ' ' ARG . 31.1 tt0 -70.24 -31.39 68.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.247 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -59.8 -48.85 80.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.042 0.449 . . . . 0.0 110.154 173.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.409 HG21 ' HB2' ' A' ' 52' ' ' GLN . 37.8 mm -62.14 -37.98 79.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.005 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -71.38 -23.81 61.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.019 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.496 ' HD3' ' HG2' ' A' ' 63' ' ' GLU . 25.5 mtp180 -99.78 13.68 32.87 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -173.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.7 m -118.69 132.41 68.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.073 0.463 . . . . 0.0 110.35 174.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.9 m -84.91 -30.72 24.14 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.084 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.416 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 39.6 m -81.19 122.2 81.2 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.036 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.605 ' HB2' ' CE1' ' A' ' 32' ' ' PHE . 10.8 Cg_exo -70.97 -33.31 12.2 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 123.073 2.515 . . . . 0.0 111.795 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.456 ' O ' ' HG3' ' A' ' 76' ' ' ARG . 52.3 ttm -60.82 -39.51 89.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.803 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.497 ' O ' ' HG3' ' A' ' 77' ' ' MET . 84.1 t -61.15 -52.0 66.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.327 177.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.509 ' HA ' ' HE2' ' A' ' 77' ' ' MET . . . -62.78 -40.7 98.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.025 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.624 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -60.32 -50.33 74.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.596 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 72' ' ' MET . 77.1 mtp180 -64.77 -47.78 76.93 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -175.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.509 ' HE2' ' HA ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -85.01 -8.29 58.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.979 0.419 . . . . 0.0 111.391 -177.696 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -93.87 -17.09 42.36 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.916 176.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -89.87 -1.15 57.92 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -175.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -82.37 131.23 35.23 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.018 174.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -106.13 22.68 15.29 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.626 0.727 . . . . 0.0 110.459 -170.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 59.8 m -70.87 -36.8 72.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.729 173.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.525 ' HE3' ' CZ ' ' A' ' 61' ' ' TYR . 16.1 pttm -86.53 158.12 54.74 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.797 175.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.422 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 60.7 Cg_endo -71.71 154.71 59.28 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.616 2.211 . . . . 0.0 113.473 -174.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.521 HD23 ' HG2' ' A' ' 55' ' ' LYS . 52.9 mt -121.57 171.95 8.45 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 175.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -70.79 141.18 51.4 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.7 -0.8 . . . . 0.0 109.37 174.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.472 ' HE3' ' HB2' ' A' ' 87' ' ' LYS . 35.1 ttmt -61.24 -46.66 89.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.168 -169.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -86.75 24.29 1.5 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.477 ' HZ2' ' CZ ' ' A' ' 51' ' ' PHE . 65.7 t-105 -59.06 -36.03 74.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.737 0.304 . . . . 0.0 111.56 -177.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.89 -30.46 67.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.839 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 28.8 m -94.8 -40.58 9.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.849 0.356 . . . . 0.0 111.075 -177.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.471 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.5 m -79.06 -8.08 11.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -176.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.446 ' O ' ' HG2' ' A' ' 97' ' ' MET . 62.3 tttp -52.83 -46.5 67.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.653 0.264 . . . . 0.0 111.155 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -77.63 -28.83 51.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.696 0.284 . . . . 0.0 111.061 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -68.88 -42.25 77.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.088 0.471 . . . . 0.0 109.988 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.468 HG12 ' CE2' ' A' ' 50' ' ' TYR . 75.4 t -61.35 -46.76 95.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.396 176.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.446 ' HG2' ' O ' ' A' ' 93' ' ' LYS . 83.2 mmm -61.04 -40.07 92.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.809 178.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 25.7 ttm-85 -62.26 -43.64 98.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.544 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -61.9 -44.46 96.75 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.884 0.373 . . . . 0.0 110.589 178.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.92 -44.21 93.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.121 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -69.53 -41.22 76.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.014 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -58.34 -53.67 55.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.539 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.97 -26.56 68.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.949 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.402 ' HA ' HG21 ' A' ' 37' ' ' ILE . 87.7 tttt -65.06 -55.31 19.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.64 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -79.3 -6.39 56.61 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.947 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.756 ' HA ' HH21 ' A' ' 112' ' ' ARG . 20.9 mt-10 -92.08 -35.45 13.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.598 0.237 . . . . 0.0 110.999 173.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.5 ' NE2' ' HB2' ' A' ' 38' ' ' LYS . 0.8 OUTLIER -66.41 -45.1 81.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.027 0.442 . . . . 0.0 110.364 179.23 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -113.81 111.41 21.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.114 -176.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.36 -22.14 66.25 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.61 178.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -57.12 -49.02 77.21 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.362 0.601 . . . . 0.0 109.873 175.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.8 mt -69.32 -38.39 78.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.231 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.756 HH21 ' HA ' ' A' ' 106' ' ' GLU . 42.5 ttm180 -58.42 -43.7 88.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.508 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.94 -43.03 99.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.836 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.7 tp -65.97 -40.15 91.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.537 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.649 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 44.0 tp -65.62 -35.39 80.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.985 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.1 mp -88.55 -3.77 58.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.881 0.372 . . . . 0.0 111.077 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.12 -34.73 24.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.048 0.452 . . . . 0.0 109.792 172.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 20.9 p -75.23 -14.96 60.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.936 176.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -59.3 138.23 88.65 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.275 176.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -104.99 39.66 3.47 Favored 'Cis proline' 0 N--CA 1.458 -0.6 0 C-N-CA 124.819 -0.909 . . . . 0.0 113.2 -2.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.515 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -75.48 176.28 7.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.94 0.4 . . . . 0.0 111.821 -176.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.625 ' HE3' HG12 ' A' ' 16' ' ' ILE . 51.6 mtmt -92.92 130.78 38.39 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.187 -179.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 59.8 mt -94.07 113.62 25.62 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.993 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.633 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 86.1 t -132.82 107.07 11.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.494 -175.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -77.34 117.82 19.2 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.424 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 7.4 t60 -85.71 113.32 21.81 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 3.6 t -136.95 112.49 9.34 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.382 0.611 . . . . 0.0 109.896 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.405 ' H ' ' HG3' ' A' ' 128' ' ' GLU . 0.0 OUTLIER -100.0 18.73 17.74 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.043 0.925 . . . . 0.0 108.548 171.327 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -95.53 -44.46 7.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.125 177.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -130.02 166.74 19.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.148 176.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.64 86.34 2.23 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.405 175.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -160.11 -35.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.124 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.659 ' HB3' HD23 ' A' ' 145' ' ' LEU . 71.5 m95 -120.79 20.71 11.63 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.485 -179.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -150.73 -150.31 5.26 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.43 -175.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.424 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 1.3 p-10 -82.43 -14.93 54.32 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 122.291 -0.534 . . . . 0.0 110.334 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.548 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 68.0 26.42 73.99 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.886 176.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 76.81 -27.26 1.64 Allowed Glycine 0 CA--C 1.52 0.375 0 N-CA-C 114.31 0.484 . . . . 0.0 114.31 176.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . 0.458 ' NE2' ' HB3' ' A' ' 140' ' ' LYS . 20.7 p-80 -132.65 11.78 4.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.518 0.659 . . . . 0.0 111.801 -172.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 99.32 -27.09 21.72 Favored Glycine 0 CA--C 1.517 0.166 0 C-N-CA 120.552 -0.832 . . . . 0.0 113.048 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.458 ' HB3' ' NE2' ' A' ' 138' ' ' HIS . 65.6 tttp -107.4 69.97 0.77 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.587 0.708 . . . . 0.0 110.025 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.548 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -124.19 15.23 7.78 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.257 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 61.2 mttt 61.97 77.05 0.34 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.773 0.797 . . . . 0.0 110.929 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.419 ' OD1' HG11 ' A' ' 124' ' ' VAL . 8.8 t30 -77.9 5.58 9.39 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.75 -176.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.483 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 69.0 mtp85 -47.37 -22.22 0.4 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -178.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.659 HD23 ' HB3' ' A' ' 133' ' ' TRP . 49.2 tp -56.59 -47.54 79.37 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.272 0.558 . . . . 0.0 110.237 173.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.604 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -67.42 -27.96 73.59 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.792 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -68.93 -37.87 79.17 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 79.6 mt -61.26 -41.87 97.67 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.6 -34.33 78.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.837 177.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.604 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 67.4 mtt -61.48 -49.24 77.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.73 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -67.38 -37.15 82.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.71 0.29 . . . . 0.0 110.805 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 68.1 tp -63.67 -42.77 98.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.032 0.444 . . . . 0.0 110.065 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.649 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 1.1 ttp-105 -61.7 -42.55 99.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.954 177.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -57.52 -43.97 84.72 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.219 177.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -66.65 -45.5 78.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.255 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.489 HD11 HD23 ' A' ' 115' ' ' LEU . 90.9 mt -69.41 -28.16 65.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.828 0.347 . . . . 0.0 110.627 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.508 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -60.8 -45.46 94.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.186 175.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 69.8 mt -69.14 -34.07 61.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.72 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -56.39 -52.8 63.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.045 0.45 . . . . 0.0 109.79 177.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -76.44 -25.2 54.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.769 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 13.7 tp -70.11 -32.56 70.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.195 0.521 . . . . 0.0 110.005 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.13 -58.68 3.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.189 177.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 33.6 p80 42.7 28.7 0.13 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.495 1.118 . . . . 0.0 113.671 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -101.06 -34.29 9.79 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -68.4 132.37 46.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.155 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 50.7 m80 -104.36 -172.63 2.14 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.433 -178.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -89.08 130.76 35.48 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 177.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 30.5 m170 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.641 -0.695 . . . . 0.0 109.975 -175.495 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.403 ' HG3' ' O ' ' A' ' 1' ' ' MET . 24.0 ptm . . . . . 0 N--CA 1.48 1.067 0 CA-C-O 121.051 0.453 . . . . 0.0 110.436 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -85.98 155.77 9.94 Favored 'Trans proline' 0 N--CA 1.453 -0.859 0 C-N-CA 122.441 2.094 . . . . 0.0 111.706 177.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -69.5 125.7 28.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 176.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -82.68 84.79 7.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.667 0.746 . . . . 0.0 109.941 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.95 44.75 1.15 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.682 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -77.81 91.68 4.14 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 173.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.0 mtt85 -77.79 162.66 26.75 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.484 -1.235 . . . . 0.0 111.511 -169.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 54.1 mt -65.47 127.29 26.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.956 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.498 ' O ' ' HB2' ' A' ' 10' ' ' HIS . 21.6 mm-40 -77.53 65.64 3.09 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.138 -179.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.498 ' HB2' ' O ' ' A' ' 9' ' ' GLN . 17.8 m80 74.23 123.64 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.954 -174.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.441 HG21 ' HB3' ' A' ' 121' ' ' ALA . 32.3 m -83.73 179.91 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.909 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 29.0 mtm -91.92 164.33 13.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.02 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -58.08 116.75 3.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.338 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 52.01 74.16 0.28 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.523 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.437 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 31.5 m -96.8 121.72 38.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.858 177.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 35.3 mm -81.33 95.78 2.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 176.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.9 mt -90.07 91.61 3.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.443 0.639 . . . . 0.0 109.794 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.603 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.3 p30 -96.49 101.96 13.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.421 178.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -102.81 132.08 49.24 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.519 -172.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -150.2 100.47 2.9 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.566 173.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.518 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 18.4 t 176.29 61.7 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -177.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.2 m -74.53 2.72 9.01 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.32 -171.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.36 -79.0 0.02 OUTLIER 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -175.37 81.65 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -170.55 -110.43 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.883 -172.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -101.26 -15.69 17.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.2 0.524 . . . . 0.0 110.243 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.518 ' HA3' ' O ' ' A' ' 21' ' ' SER . . . -74.08 -0.45 56.45 Favored Glycine 0 CA--C 1.52 0.364 0 CA-C-N 115.863 -0.608 . . . . 0.0 113.303 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.36 -1.56 3.57 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.023 0.44 . . . . 0.0 112.004 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -65.17 -32.31 73.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.578 169.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.9 m -62.99 156.71 23.82 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.437 0.637 . . . . 0.0 112.046 -174.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.599 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 5.5 p-10 -70.66 -24.93 62.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.906 178.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -76.6 -2.26 31.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.715 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.425 ' O ' HG21 ' A' ' 46' ' ' THR . . . -64.72 136.1 56.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.945 -177.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.79 57.83 2.66 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.456 -172.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 66.2 m95 -116.63 105.5 49.88 Favored Pre-proline 0 C--N 1.316 -0.86 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.607 177.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.27 138.18 78.86 Favored 'Trans proline' 0 C--O 1.238 0.482 0 C-N-CA 123.324 2.683 . . . . 0.0 113.029 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.401 HG13 ' HB2' ' A' ' 44' ' ' TRP . 16.2 pt -123.81 137.65 56.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.363 -178.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -98.66 107.67 20.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.423 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.0 t -123.72 113.27 36.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -174.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 55.27 36.72 27.65 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.437 172.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.08 -1.18 62.74 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.502 173.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -129.34 144.7 51.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 117.635 0.718 . . . . 0.0 110.42 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.0 m -98.53 122.74 42.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.861 -175.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.454 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 41.5 m95 -112.16 134.55 21.44 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.642 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 37.9 Cg_exo -60.79 -41.63 44.56 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.833 2.355 . . . . 0.0 112.554 -177.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.425 HG21 ' O ' ' A' ' 33' ' ' ALA . 21.0 p -144.77 178.63 7.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.698 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.599 ' HB2' ' HB2' ' A' ' 31' ' ' ASN . 21.5 m -74.02 -44.1 55.62 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -173.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.466 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 1.9 pm0 -76.93 -10.31 59.28 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.502 -173.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.516 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 11.2 m80 -71.74 -38.01 70.49 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 172.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -71.46 -35.81 70.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.466 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 83.0 t80 -59.89 -56.42 21.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.549 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.503 ' NE2' ' HA3' ' A' ' 78' ' ' GLY . 5.1 mm100 -66.28 -21.7 66.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.211 -0.45 . . . . 0.0 112.016 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.441 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -76.32 -48.99 18.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.004 0.43 . . . . 0.0 110.455 176.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.47 -14.48 62.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.136 0.493 . . . . 0.0 110.338 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -60.64 -34.45 74.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.769 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.502 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 96.8 m-85 -109.17 157.7 18.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.383 -178.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.14 32.7 5.33 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.265 0.555 . . . . 0.0 111.1 -177.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.503 ' OD2' ' HB2' ' A' ' 60' ' ' LYS . 8.6 t70 -136.0 118.34 15.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.518 178.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.535 ' HA ' ' HB2' ' A' ' 62' ' ' ARG . 21.4 mm-40 -65.97 -14.07 60.93 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -177.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.503 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . 58.4 mttp -72.71 -55.11 7.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.96 0.409 . . . . 0.0 109.956 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.404 ' O ' HG12 ' A' ' 65' ' ' ILE . 55.2 t80 -71.6 -26.0 62.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.933 0.397 . . . . 0.0 110.321 177.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.535 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . 12.5 mtp180 -71.44 -27.34 63.21 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.805 0.336 . . . . 0.0 110.507 175.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.3 tt0 -69.91 -32.38 70.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 170.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.02 -40.75 95.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.591 175.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.425 HD11 ' HE1' ' A' ' 77' ' ' MET . 40.5 mm -65.16 -29.79 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.693 0.758 . . . . 0.0 110.29 175.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -74.58 -29.54 61.37 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.267 174.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -81.01 -28.47 35.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.207 -177.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.452 ' O ' HG12 ' A' ' 68' ' ' VAL . 10.3 p -70.83 101.37 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.722 0.772 . . . . 0.0 110.139 177.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.9 m -76.05 -26.17 56.32 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.966 -177.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.458 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.1 m -78.97 133.47 61.46 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.395 178.253 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.516 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 28.0 Cg_exo -62.12 -65.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.359 2.706 . . . . 0.0 113.986 -175.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 27.8 ttt -68.95 -26.45 65.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.776 0.322 . . . . 0.0 111.5 -172.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 86.3 t -62.82 -28.88 45.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.041 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.77 -47.49 84.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.031 0.443 . . . . 0.0 110.707 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.99 -30.52 62.52 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.95 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.412 ' HE ' ' C ' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -63.11 -49.12 75.65 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.574 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.425 ' HE1' HD11 ' A' ' 65' ' ' ILE . 25.2 ptt? -77.54 -24.67 49.87 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 176.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.503 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -76.78 -2.14 75.17 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.274 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 76' ' ' ARG . 21.3 mmt180 -67.18 -18.77 65.41 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 122.31 0.244 . . . . 0.0 110.883 170.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.509 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 20.5 t70 -69.07 134.12 48.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.024 0.44 . . . . 0.0 110.402 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' A' ' 81' ' ' ARG . 24.6 ttp-105 -118.18 17.87 13.89 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.278 -175.282 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 88.2 p -98.13 0.39 45.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.503 0.668 . . . . 0.0 109.593 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.509 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 41.1 mmtm -95.75 153.26 39.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 174.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.69 103.85 1.71 Allowed 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 121.44 1.426 . . . . 0.0 112.075 -178.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.403 HD22 ' HG3' ' A' ' 81' ' ' ARG . 2.4 pp -109.68 169.85 8.44 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.165 176.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 -86.07 133.23 33.9 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.04 -176.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -70.6 -33.39 71.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.842 0.353 . . . . 0.0 111.0 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -85.4 9.98 14.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.096 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.456 ' HA ' HG22 ' A' ' 92' ' ' VAL . 67.8 t-105 -54.5 -30.44 53.43 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.969 0.414 . . . . 0.0 110.203 175.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -53.66 -32.23 50.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.618 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.2 m -99.82 -45.46 5.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.698 0.285 . . . . 0.0 111.498 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.456 HG22 ' HA ' ' A' ' 89' ' ' TRP . 31.9 m -74.94 -11.22 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -171.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.4 pttm -63.27 -29.59 70.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.771 0.32 . . . . 0.0 110.647 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.483 ' OE1' ' HD3' ' A' ' 144' ' ' ARG . 9.5 mm-40 -68.16 -39.89 82.47 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.644 0.735 . . . . 0.0 109.49 177.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.87 -41.66 67.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.882 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 92' ' ' VAL . 79.7 t -63.8 -39.55 85.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.065 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.8 mmt -62.49 -46.14 89.81 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.576 176.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.718 HH21 HD23 ' A' ' 148' ' ' LEU . 26.1 ttm180 -63.75 -32.57 74.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.35 . . . . 0.0 110.545 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -63.93 -50.33 69.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.365 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.36 87.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.976 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.6 -35.52 80.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.098 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -58.88 -53.83 53.97 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.95 -37.51 82.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.739 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -52.61 -54.02 38.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.357 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -86.5 -8.38 57.62 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.684 ' HA ' HH21 ' A' ' 112' ' ' ARG . 24.9 mt-10 -92.61 -33.01 14.58 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 121.868 -0.52 . . . . 0.0 111.518 175.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -79.17 -30.87 43.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.674 0.273 . . . . 0.0 110.761 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -115.28 103.38 10.76 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.778 0.323 . . . . 0.0 110.997 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.439 ' HA ' ' HB3' ' A' ' 112' ' ' ARG . . . -65.26 -24.42 67.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.513 178.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.435 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 2.0 mp0 -51.4 -56.08 15.13 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.455 172.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.9 mt -74.2 -31.65 62.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.333 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.684 HH21 ' HA ' ' A' ' 106' ' ' GLU . 13.7 tpp85 -50.48 -60.62 2.82 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.316 177.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.16 -34.35 70.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.025 -176.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.91 -40.22 94.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.434 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 29.3 tp -67.64 -49.56 62.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.278 178.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.492 HD21 ' HG3' ' A' ' 153' ' ' ARG . 53.0 mt -63.56 -24.89 68.0 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -173.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -74.47 -7.22 52.28 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 72.0 p -86.8 -15.4 39.38 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.363 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.425 ' HA ' HH21 ' A' ' 153' ' ' ARG . . . -54.87 141.86 56.74 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.394 177.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . 0.524 ' HA ' HH21 ' A' ' 153' ' ' ARG . 43.9 Cg_endo -101.22 41.94 3.45 Favored 'Cis proline' 0 CA--C 1.535 0.572 0 C-N-CA 124.5 -1.042 . . . . 0.0 113.134 -1.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.441 ' HB3' HG21 ' A' ' 11' ' ' VAL . . . -72.92 166.93 22.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.94 0.4 . . . . 0.0 111.704 -178.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 39.3 tttp -100.98 119.35 38.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.589 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 24.2 mt -88.7 125.35 34.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.433 -175.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.603 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 42.2 t -134.36 134.11 54.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.432 -175.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.504 ' HB3' ' HA3' ' A' ' 134' ' ' GLY . 0.0 OUTLIER -81.02 137.66 36.04 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.31 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 18' ' ' ASN . 23.7 t-160 -130.77 79.94 1.92 Allowed 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.55 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.5 t -87.55 166.22 14.9 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 164.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -140.16 67.75 1.37 Allowed 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.833 0.825 . . . . 0.0 110.454 -176.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -162.69 -44.85 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.866 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.493 ' O ' ' HA2' ' A' ' 136' ' ' GLY . 2.6 m-20 -125.9 -179.9 4.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -124.17 86.19 2.53 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 170.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -97.35 -49.55 4.88 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -167.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.621 ' HB3' ' HB2' ' A' ' 145' ' ' LEU . 78.9 m95 -140.06 25.18 2.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.457 0.646 . . . . 0.0 110.588 178.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.513 ' HA2' ' HA ' ' A' ' 143' ' ' ASN . . . -163.07 -84.22 0.05 OUTLIER Glycine 0 N--CA 1.439 -1.163 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.575 -177.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -160.1 164.28 33.17 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.502 -178.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.493 ' HA2' ' O ' ' A' ' 130' ' ' ASP . . . -98.38 24.12 33.32 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 175.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 74.24 37.27 48.76 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 115.071 -0.565 . . . . 0.0 113.748 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -144.58 -27.0 0.5 Allowed 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' A' ' 140' ' ' LYS . . . 99.71 56.44 0.96 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.282 -0.485 . . . . 0.0 113.218 174.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 139' ' ' GLY . 13.0 ttpp 169.86 69.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 123.675 0.79 . . . . 0.0 109.126 176.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -132.35 -65.11 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 119.333 -1.413 . . . . 0.0 114.363 -175.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.414 ' C ' ' H ' ' A' ' 144' ' ' ARG . 39.6 tttm -178.51 52.08 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.499 0.65 . . . . 0.0 111.088 -171.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.513 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 3.4 t-20 -69.28 5.29 1.32 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.076 0.95 . . . . 0.0 111.708 -177.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.69 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 1.6 ttt180 -57.58 -21.43 38.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.621 ' HB2' ' HB3' ' A' ' 133' ' ' TRP . 23.6 tp -65.53 -44.45 86.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.357 175.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -66.35 -32.14 81.06 Favored Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.177 175.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . 0.424 ' HA ' ' HE2' ' A' ' 150' ' ' MET . 60.7 t80 -61.85 -40.57 95.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.017 0.437 . . . . 0.0 110.032 175.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.718 HD23 HH21 ' A' ' 98' ' ' ARG . 46.4 mt -63.73 -45.5 89.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.767 174.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.4 mt -61.02 -46.24 91.53 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.33 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.424 ' HE2' ' HA ' ' A' ' 147' ' ' TYR . 58.1 mtm -64.84 -43.4 93.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.907 -176.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.441 ' O ' ' HG2' ' A' ' 155' ' ' GLN . 33.4 mt-10 -63.73 -44.97 91.96 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.64 176.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.44 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 58.7 tp -58.82 -45.21 90.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.182 0.515 . . . . 0.0 110.161 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.821 ' HB3' HH11 ' A' ' 153' ' ' ARG . 1.2 ttp-105 -57.82 -43.48 85.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.873 177.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.7 -40.79 97.66 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.802 177.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.856 HE21 ' HA ' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -65.87 -41.45 91.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.749 179.437 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.469 ' HB2' HD23 ' A' ' 116' ' ' LEU . 97.2 mt -66.13 -36.36 82.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.859 0.361 . . . . 0.0 110.267 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -63.72 -42.48 97.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.858 177.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 77.5 mt -70.22 -43.79 78.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.704 0.288 . . . . 0.0 111.046 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -62.71 -29.12 70.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.293 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -87.28 -29.66 21.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.433 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 15.9 tp -62.05 -35.49 78.79 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.879 -177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -79.68 11.72 3.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.782 -0.644 . . . . 0.0 112.175 -176.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -75.86 -8.37 56.72 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 122.284 -0.26 . . . . 0.0 111.344 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -68.37 -76.69 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.683 0.278 . . . . 0.0 110.867 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 22.1 t-80 -121.08 106.34 11.46 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 42.4 t60 -171.14 127.07 0.69 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.511 -170.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -91.42 -71.1 0.65 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.411 177.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.261 -0.876 . . . . 0.0 109.575 177.521 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.4 mtt . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 120.66 0.266 . . . . 0.0 110.574 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -69.18 93.45 0.47 Allowed 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.621 2.214 . . . . 0.0 111.878 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.457 ' O ' ' HB2' ' A' ' 25' ' ' ASP . 12.5 p -79.67 -22.96 12.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.355 -177.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 4' ' ' ARG . 14.7 mtp180 66.27 -79.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.303 -175.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.592 ' HB2' HD23 ' A' ' 114' ' ' LEU . . . 73.01 -40.29 0.47 Allowed 'General case' 0 N--CA 1.469 0.497 0 O-C-N 124.004 0.815 . . . . 0.0 112.062 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -68.46 100.98 1.16 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.905 0.383 . . . . 0.0 111.773 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -109.85 -42.14 4.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 168.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 38.3 pt -107.01 159.85 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.217 171.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.644 ' HA ' HE21 ' A' ' 9' ' ' GLN . 0.1 OUTLIER -144.23 108.69 4.84 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.155 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.2 t60 67.69 107.27 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.891 0.745 . . . . 0.0 110.935 -178.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -83.91 168.0 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.269 177.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.504 ' HE2' ' HB ' ' A' ' 15' ' ' THR . 0.0 OUTLIER -80.73 -84.55 0.1 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.965 -179.156 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.5 ' H ' ' HG2' ' A' ' 12' ' ' MET . 81.9 mm-40 -133.61 -72.17 0.5 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -175.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -137.16 86.8 2.23 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.712 -171.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.504 ' HB ' ' HE2' ' A' ' 12' ' ' MET . 3.3 t -117.94 149.93 40.08 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.34 178.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.494 HD13 ' HB2' ' A' ' 122' ' ' LYS . 32.1 mm -94.68 113.18 28.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.924 177.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.0 mt -96.05 101.89 12.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 120.924 0.392 . . . . 0.0 110.301 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 22.9 m-80 -84.86 104.21 14.61 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.014 177.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -109.92 130.61 55.51 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.92 0.391 . . . . 0.0 110.467 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -150.54 137.82 19.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.968 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.1 m 73.18 130.41 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 O-C-N 124.144 0.902 . . . . 0.0 111.444 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.492 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 20.6 p -56.38 -30.7 63.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.827 -178.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.7 m 62.82 -85.94 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.691 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -160.41 -40.97 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.457 ' HB2' ' O ' ' A' ' 3' ' ' VAL . 4.3 p-10 -137.54 -52.7 0.65 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 120.154 -0.618 . . . . 0.0 112.595 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -77.68 -9.77 59.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.115 0.483 . . . . 0.0 111.59 -174.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.492 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -76.7 -0.52 68.55 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 116.187 -0.461 . . . . 0.0 113.279 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.416 ' CG ' ' HZ1' ' A' ' 104' ' ' LYS . 26.6 t70 -53.07 -25.89 14.28 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -178.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -62.78 -18.91 63.42 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.9 m -78.84 136.73 37.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.978 0.418 . . . . 0.0 109.943 175.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -65.48 -15.65 62.87 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.837 -174.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -88.79 20.97 3.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.982 0.42 . . . . 0.0 110.955 -176.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.64 175.42 2.92 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.953 171.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -134.9 81.7 1.91 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.892 0.377 . . . . 0.0 111.681 -176.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.461 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 92.9 m95 -121.1 137.23 26.41 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.465 177.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 7.4 Cg_exo -72.03 112.08 3.33 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.748 2.299 . . . . 0.0 111.544 177.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.488 HG13 ' HB2' ' A' ' 44' ' ' TRP . 17.4 pt -107.27 117.21 52.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.319 0.58 . . . . 0.0 110.649 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -81.58 95.69 7.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.862 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.427 ' HB ' ' CD1' ' A' ' 44' ' ' TRP . 24.7 t -118.61 125.18 74.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.288 -177.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.6 t70 62.48 28.49 16.8 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.714 0.769 . . . . 0.0 110.07 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.32 7.34 87.78 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.375 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -117.67 137.23 52.8 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.648 0.261 . . . . 0.0 110.386 -176.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.1 m -87.72 98.03 11.22 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.434 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.488 ' HB2' HG13 ' A' ' 37' ' ' ILE . 66.9 m95 -90.41 126.19 57.3 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 11.2 Cg_exo -72.15 61.16 3.24 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.852 2.368 . . . . 0.0 112.418 178.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 93.2 165.15 0.03 OUTLIER 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.338 1.055 . . . . 0.0 111.323 172.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.4 p -52.41 -43.91 65.07 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.34 -173.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -43.56 -45.28 6.56 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 123.553 0.533 . . . . 0.0 112.205 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -74.34 -46.17 42.45 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.141 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -60.72 -35.57 76.66 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.152 0.501 . . . . 0.0 110.522 175.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.479 ' CZ ' ' HZ2' ' A' ' 89' ' ' TRP . 81.4 t80 -59.95 -57.45 12.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.239 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -67.3 -34.0 76.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.324 -176.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.95 -30.65 71.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.902 0.382 . . . . 0.0 111.081 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.587 ' HG2' HG22 ' A' ' 96' ' ' VAL . 4.5 tp-100 -85.95 -26.89 25.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.114 0.483 . . . . 0.0 109.893 178.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -67.84 -47.87 67.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.385 -178.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -90.47 143.17 27.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.05 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.597 ' H ' HD23 ' A' ' 57' ' ' LEU . 2.2 pt? -102.66 3.13 36.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.0 110.328 176.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.32 122.87 22.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.639 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -63.58 -51.01 67.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.655 -173.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 63' ' ' GLU . 24.9 ttpp -68.44 -34.21 75.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.817 0.341 . . . . 0.0 110.359 -177.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.651 ' O ' HG12 ' A' ' 65' ' ' ILE . 2.0 t80 -68.34 -34.53 76.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.316 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -62.1 -35.72 79.54 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.989 0.423 . . . . 0.0 110.193 174.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.463 ' HB3' ' O ' ' A' ' 60' ' ' LYS . 10.1 tp10 -61.2 -45.65 93.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.696 174.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.504 ' HA ' ' HB2' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -62.04 -35.16 77.76 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.547 176.693 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.651 HG12 ' O ' ' A' ' 61' ' ' TYR . 48.9 mm -62.51 -40.35 87.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.795 0.331 . . . . 0.0 110.766 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -90.03 -0.41 57.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.173 0.511 . . . . 0.0 110.456 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.504 ' HB2' ' HA ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -83.03 -30.31 28.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.328 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.1 m -90.96 133.46 32.62 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.136 -176.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.3 m -81.72 -38.95 24.96 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.641 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.4 ' HB2' HG22 ' A' ' 73' ' ' VAL . 17.0 m -77.9 124.77 86.18 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.266 -177.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -65.5 -27.86 53.93 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.72 2.28 . . . . 0.0 111.724 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 79.6 mtp -60.2 -39.24 85.87 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.887 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.567 ' O ' ' HG2' ' A' ' 77' ' ' MET . 46.0 t -66.53 -43.62 90.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.02 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.23 -47.37 85.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.941 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.534 ' O ' ' HG3' ' A' ' 79' ' ' ARG . . . -61.1 -47.8 84.63 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.891 0.377 . . . . 0.0 111.039 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -58.25 -49.56 76.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.86 -177.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.567 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 26.0 ptt? -81.66 -11.53 59.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.79 0.329 . . . . 0.0 110.94 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -81.26 -16.51 73.97 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.013 -0.613 . . . . 0.0 111.892 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 75' ' ' ALA . 92.9 mtt180 -79.74 -10.32 59.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.554 0.216 . . . . 0.0 110.963 175.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.472 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 22.3 t70 -72.09 140.22 48.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.673 -176.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 87.7 mtm-85 -122.95 20.27 10.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.873 0.368 . . . . 0.0 111.274 -177.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.8 p -98.17 5.69 48.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.556 0.693 . . . . 0.0 109.187 172.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.472 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 43.6 mmtm -102.69 159.28 29.81 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.255 175.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.84 108.08 0.85 Allowed 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.262 1.974 . . . . 0.0 112.498 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 89.0 mt -98.63 151.45 20.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.216 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.611 HH21 ' ND2' ' A' ' 88' ' ' ASN . 16.4 ptm180 -96.88 140.52 31.31 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.353 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.62 ' HA ' ' HE2' ' A' ' 87' ' ' LYS . 0.6 OUTLIER -78.07 -28.3 48.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.146 0.498 . . . . 0.0 109.944 -178.289 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.611 ' ND2' HH21 ' A' ' 86' ' ' ARG . 22.9 p-10 -83.26 15.86 2.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.853 178.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.479 ' HZ2' ' CZ ' ' A' ' 51' ' ' PHE . 38.0 t-105 -62.41 -37.39 85.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.111 175.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.8 -31.6 72.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.939 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.3 m -71.59 -46.63 58.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.199 -178.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.498 ' O ' HG21 ' A' ' 96' ' ' VAL . 34.8 m -92.37 -1.31 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.549 -175.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.579 ' HG2' ' HZ2' ' A' ' 133' ' ' TRP . 80.8 tttt -48.57 -53.2 19.27 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 123.383 0.673 . . . . 0.0 111.292 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -66.83 -40.58 88.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.855 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -62.15 -49.74 74.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.953 -177.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.587 HG22 ' HG2' ' A' ' 54' ' ' GLN . 77.5 t -58.08 -48.98 82.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.895 -178.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 4.4 mmt -59.6 -53.77 54.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.677 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.438 ' HD3' HD23 ' A' ' 148' ' ' LEU . 38.8 ttp85 -69.94 -29.71 66.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.456 -174.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -70.49 -42.29 71.56 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.62 0.248 . . . . 0.0 110.512 178.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.71 -43.98 87.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.094 0.473 . . . . 0.0 110.283 178.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.458 HD12 HD23 ' A' ' 149' ' ' LEU . 76.6 mt -62.38 -42.64 99.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.756 176.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.517 ' HA ' HD23 ' A' ' 152' ' ' LEU . 41.4 ttm180 -56.27 -50.17 72.11 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.159 176.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.81 -37.09 70.7 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 123.487 0.492 . . . . 0.0 111.902 -177.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.416 ' HZ1' ' CG ' ' A' ' 28' ' ' ASP . 29.8 ttpt -68.11 -55.6 11.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.636 0.255 . . . . 0.0 110.816 -178.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 84.2 m-85 -70.14 -29.69 66.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.917 0.389 . . . . 0.0 111.245 -177.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -67.48 -44.35 78.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.087 0.47 . . . . 0.0 110.595 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -84.68 -31.3 24.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.967 -172.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -108.74 110.83 22.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.263 0.554 . . . . 0.0 111.019 177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.48 -26.43 66.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.531 -177.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -58.94 -49.43 77.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.456 0.646 . . . . 0.0 109.837 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.05 -36.23 66.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.337 -175.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 1.6 ttp180 -65.34 -39.16 92.03 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.506 177.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.58 -45.07 95.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.979 175.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.592 HD23 ' HB2' ' A' ' 5' ' ' ALA . 61.5 tp -60.78 -47.14 87.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.611 177.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.537 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 53.2 tp -59.31 -50.51 73.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.184 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.49 HD13 ' HG3' ' A' ' 112' ' ' ARG . 9.5 mp -73.55 -11.31 60.4 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.05 -21.19 33.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.589 0.233 . . . . 0.0 111.194 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 77.6 p -82.66 -21.56 34.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.932 0.396 . . . . 0.0 110.861 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.504 ' HB1' ' HD2' ' A' ' 153' ' ' ARG . . . -59.71 141.48 88.82 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.185 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -100.08 41.33 3.83 Favored 'Cis proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.222 -1.158 . . . . 0.0 113.676 1.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.51 165.3 24.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.827 0.346 . . . . 0.0 110.644 177.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.494 ' HB2' HD13 ' A' ' 16' ' ' ILE . 65.8 mttt -94.8 125.34 39.39 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.251 0.548 . . . . 0.0 111.343 -177.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 62.5 mt -86.64 101.35 13.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.185 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 87.0 t -116.1 106.55 20.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.351 -179.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -75.68 119.66 20.0 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 175.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -88.78 77.49 7.83 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.634 0.731 . . . . 0.0 109.153 -176.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.432 ' HB ' ' HA3' ' A' ' 134' ' ' GLY . 22.5 m -96.82 105.64 17.8 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.295 176.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -98.89 -9.23 24.47 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.727 -172.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.447 ' O ' ' HB2' ' A' ' 130' ' ' ASP . 28.2 t-20 -96.52 96.55 8.75 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' A' ' 129' ' ' ASN . 5.6 m-20 69.69 154.44 0.12 Allowed 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.985 0.803 . . . . 0.0 111.214 -172.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB2' ' HA3' ' A' ' 141' ' ' GLY . . . -99.54 85.6 3.18 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.35 0.595 . . . . 0.0 109.478 173.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.53 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 63.6 t80 -134.97 102.29 5.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.145 -178.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.735 ' HB3' HD22 ' A' ' 145' ' ' LEU . 78.5 m95 63.53 17.6 10.48 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.845 0.716 . . . . 0.0 110.209 -172.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.432 ' HA3' ' HB ' ' A' ' 127' ' ' THR . . . -148.46 155.76 26.56 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.509 ' CG ' ' HB2' ' A' ' 143' ' ' ASN . 2.9 m-20 -88.68 34.44 0.77 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -170.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 59.18 21.33 53.14 Favored Glycine 0 C--O 1.228 -0.28 0 C-N-CA 121.187 -0.53 . . . . 0.0 112.523 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 79.08 -53.11 4.11 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.68 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -67.91 -31.41 71.16 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.646 0.609 . . . . 0.0 112.646 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 119.83 42.15 0.54 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.996 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.5 tttt -172.77 87.32 0.07 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 174.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.41 ' HA3' ' HB2' ' A' ' 131' ' ' ALA . . . -152.74 -64.75 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 119.586 -1.292 . . . . 0.0 113.398 173.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.53 ' HD2' ' HA ' ' A' ' 132' ' ' TYR . 58.0 mttp -164.14 43.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.879 0.34 . . . . 0.0 111.029 -174.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.509 ' HB2' ' CG ' ' A' ' 135' ' ' ASP . 4.0 t-20 -61.1 4.95 0.07 Allowed 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 177.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.546 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 32.2 mtp180 -58.39 -24.13 59.11 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 122.167 -0.333 . . . . 0.0 110.916 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.735 HD22 ' HB3' ' A' ' 133' ' ' TRP . 47.5 tp -61.95 -50.67 71.19 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.006 0.431 . . . . 0.0 110.046 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.626 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -64.75 -32.82 85.47 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.545 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -65.44 -40.92 93.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.807 0.337 . . . . 0.0 110.437 176.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.0 mt -62.12 -38.7 89.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.004 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.458 HD23 HD12 ' A' ' 101' ' ' LEU . 77.8 mt -63.31 -36.93 85.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.82 176.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.626 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 60.8 mtt -61.73 -51.94 66.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.0 0.428 . . . . 0.0 110.128 177.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -63.37 -43.07 98.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.279 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.517 HD23 ' HA ' ' A' ' 102' ' ' ARG . 65.6 tp -61.37 -46.43 90.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.992 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.537 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 29.4 ttp85 -59.16 -39.45 82.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.713 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -65.3 -42.78 92.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.123 0.487 . . . . 0.0 110.106 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -63.59 -39.77 95.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.282 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.474 HD11 ' HD3' ' A' ' 112' ' ' ARG . 67.2 mt -78.9 -12.8 60.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.981 0.419 . . . . 0.0 110.516 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.468 ' HA ' HD21 ' A' ' 116' ' ' LEU . . . -78.66 -33.82 46.79 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.8 173.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.426 ' O ' ' HG3' ' A' ' 162' ' ' GLU . 1.4 mp -56.9 -38.28 58.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.835 177.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -63.42 -34.79 78.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.892 0.377 . . . . 0.0 110.46 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -72.79 -25.27 61.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.695 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.52 -23.72 61.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.878 0.37 . . . . 0.0 110.395 175.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 158' ' ' ILE . 46.0 mt-10 -75.98 9.47 2.42 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.376 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -77.74 -5.71 51.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.967 0.413 . . . . 0.0 110.861 177.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -93.31 122.13 35.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.648 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.427 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 46.5 m80 -94.12 -165.76 1.37 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.677 -176.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.427 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 51.0 m-70 70.15 37.54 1.64 Allowed 'General case' 0 N--CA 1.468 0.437 0 O-C-N 123.478 0.486 . . . . 0.0 111.369 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -157.21 103.66 2.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.819 0.342 . . . . 0.0 110.867 176.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 83.4 t60 . . . . . 0 C--O 1.244 0.813 0 CA-C-O 118.415 -0.803 . . . . 0.0 109.721 178.092 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.3 mmm . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 120.662 0.267 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -79.98 91.84 1.15 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.694 2.263 . . . . 0.0 110.222 173.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.4 t 70.74 138.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.922 -171.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 61.8 mtm-85 -81.6 48.75 1.22 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.573 0.701 . . . . 0.0 110.977 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.442 ' HB2' HD12 ' A' ' 114' ' ' LEU . . . -85.63 -174.29 5.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.483 174.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 59.83 30.92 20.46 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 123.13 0.269 . . . . 0.0 110.883 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -48.03 72.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.133 0.492 . . . . 0.0 109.939 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.4 mt -107.29 124.5 63.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -66.97 -37.27 83.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.942 0.401 . . . . 0.0 111.611 -175.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -154.01 131.67 11.46 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.954 -175.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.8 m -84.98 -178.06 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.06 0.457 . . . . 0.0 110.799 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.4 mtm -100.28 165.83 11.28 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.844 -178.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.99 112.18 3.71 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 175.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 64.84 83.06 0.17 Allowed 'General case' 0 C--N 1.331 -0.231 0 O-C-N 123.943 0.777 . . . . 0.0 110.598 -174.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.486 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 31.7 m -115.12 120.49 39.95 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.398 177.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 31.6 mt -96.98 107.16 19.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.325 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.6 mt -101.64 101.14 11.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.706 -175.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.524 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 38.0 m-80 -87.3 105.02 16.95 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.529 175.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -110.77 166.77 10.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.33 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -150.12 122.9 8.66 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.538 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 81.2 p 56.57 -176.57 0.05 Allowed 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.0 0.92 . . . . 0.0 111.941 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.526 HG23 ' HA ' ' A' ' 28' ' ' ASP . 40.6 p -80.86 -27.84 36.25 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -172.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.425 ' HG ' ' C ' ' A' ' 22' ' ' THR . 61.5 p 50.98 -90.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.787 0.835 . . . . 0.0 112.045 -177.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -107.56 -93.3 0.4 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -131.95 0.48 3.87 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.018 0.437 . . . . 0.0 110.77 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -101.26 -13.85 17.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.103 0.478 . . . . 0.0 110.986 -176.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.483 ' C ' ' HA ' ' A' ' 22' ' ' THR . . . -94.08 0.24 66.46 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.126 -175.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.526 ' HA ' HG23 ' A' ' 22' ' ' THR . 36.3 m-20 -62.11 0.95 0.35 Allowed 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -174.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -62.3 -31.22 71.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.759 0.314 . . . . 0.0 110.25 171.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 74.7 m -58.48 153.15 16.52 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.511 0.672 . . . . 0.0 112.335 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -76.85 -16.45 59.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.716 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -86.42 6.28 30.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.031 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.0 146.17 39.17 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.844 177.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.513 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -91.21 21.1 4.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.683 -173.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.446 ' HE1' ' CG ' ' A' ' 28' ' ' ASP . 77.4 m95 -89.85 124.85 62.67 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-O 120.713 0.292 . . . . 0.0 110.959 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.416 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 36.6 Cg_endo -66.71 128.59 19.26 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.554 2.169 . . . . 0.0 111.931 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.618 HG21 ' HA ' ' A' ' 104' ' ' LYS . 16.0 pt -103.12 137.75 30.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.915 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.43 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 43.4 tptt -100.2 101.18 12.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.057 -178.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.423 ' O ' ' HB3' ' A' ' 40' ' ' ASP . 42.1 t -115.63 125.03 72.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.469 -178.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.423 ' HB3' ' O ' ' A' ' 39' ' ' VAL . 20.6 t70 74.96 -62.67 0.45 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.363 1.078 . . . . 0.0 110.174 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.31 28.69 0.04 OUTLIER Glycine 0 C--N 1.298 -1.53 0 CA-C-N 113.3 -1.773 . . . . 0.0 109.928 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.1 mttp -135.39 142.01 45.6 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -172.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.9 m -102.09 106.42 17.3 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.764 -175.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.478 ' HB2' HG13 ' A' ' 37' ' ' ILE . 49.4 m95 -93.25 122.34 63.4 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.587 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 44' ' ' TRP . 4.4 Cg_endo -48.26 -36.31 29.24 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.698 2.932 . . . . 0.0 114.007 -175.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.513 HG22 ' HA ' ' A' ' 34' ' ' ALA . 55.2 p -148.3 166.22 28.68 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.9 t -63.41 -39.88 95.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.589 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.645 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 5.0 mm-40 -57.64 -37.64 73.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.834 178.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.402 ' CG ' ' HG2' ' A' ' 45' ' ' PRO . 25.7 m80 -60.93 -43.87 98.02 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.551 0.215 . . . . 0.0 111.332 -178.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -68.49 -38.83 81.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.887 0.375 . . . . 0.0 110.683 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -62.71 -45.76 91.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.616 -179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.645 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 53.0 mm-40 -70.06 -33.91 72.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.749 -178.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.34 -44.61 82.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.426 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -81.62 -12.04 58.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.309 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.577 ' HE3' ' HA ' ' A' ' 79' ' ' ARG . 51.1 tttm -65.95 -28.34 68.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.708 175.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.613 ' CE1' ' HB2' ' A' ' 83' ' ' LYS . 96.3 m-85 -110.71 166.5 10.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.182 0.515 . . . . 0.0 111.185 -178.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.569 ' H ' HD22 ' A' ' 57' ' ' LEU . 2.2 pt? -123.25 2.71 9.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.438 175.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -76.27 138.59 40.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.649 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -62.92 -56.15 19.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.562 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -58.84 -47.56 84.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.986 -173.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.471 ' CE2' ' HG3' ' A' ' 83' ' ' LYS . 0.5 OUTLIER -72.67 -41.19 65.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.089 -172.936 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -66.36 -30.97 71.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.433 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.405 ' CD ' HH21 ' A' ' 66' ' ' ARG . 14.1 tp10 -62.93 -47.48 83.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.037 174.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -61.63 -52.59 63.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.413 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.1 mt -63.32 -27.73 43.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.682 -175.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.405 HH21 ' CD ' ' A' ' 63' ' ' GLU . 46.4 ttp180 -73.49 -34.08 65.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.762 0.315 . . . . 0.0 111.346 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -99.14 -16.62 18.54 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -173.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.98 127.93 32.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.887 0.375 . . . . 0.0 110.057 178.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 p -85.12 -35.43 21.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.772 0.32 . . . . 0.0 110.935 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.449 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 15.5 m -58.61 116.19 14.33 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.616 -178.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 10.1 Cg_exo -71.99 -44.26 0.97 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.013 2.475 . . . . 0.0 112.529 -178.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.441 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 13.7 tpt -63.55 -42.92 98.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.413 -177.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 64.9 t -65.49 -41.15 90.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.901 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.8 -44.68 90.83 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.312 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.09 -34.81 64.1 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.978 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 72' ' ' MET . 0.7 OUTLIER -65.21 -45.9 82.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.171 -176.825 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -94.14 -2.04 53.3 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.009 0.433 . . . . 0.0 110.423 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.407 ' C ' ' H ' ' A' ' 80' ' ' ASP . . . -82.57 -51.26 4.39 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.298 -178.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.577 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 84.5 mtm-85 -82.68 25.3 0.66 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.33 0.586 . . . . 0.0 110.747 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.407 ' H ' ' C ' ' A' ' 78' ' ' GLY . 8.1 t70 -73.57 157.75 36.11 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.454 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 52.2 mtm180 -122.89 8.7 9.36 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.1 m -68.67 -28.04 66.51 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 170.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.613 ' HB2' ' CE1' ' A' ' 56' ' ' PHE . 25.5 mmtm -94.49 154.41 40.19 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.908 177.648 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.56 171.8 14.65 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.492 2.128 . . . . 0.0 112.791 -177.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 93.8 mt -126.94 173.41 9.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.309 0.576 . . . . 0.0 111.314 -178.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -84.28 152.73 23.98 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.022 177.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -78.89 -29.43 44.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.434 0.635 . . . . 0.0 109.76 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 22.3 p30 -92.18 13.53 18.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.604 176.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.577 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 42.5 t-105 -57.72 -29.58 64.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.55 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.563 ' HA ' ' HZ1' ' A' ' 93' ' ' LYS . 28.8 mm-40 -63.92 -37.58 87.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.319 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.3 t -90.35 -20.82 22.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.773 0.32 . . . . 0.0 111.837 -174.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.515 ' HA ' ' HB3' ' A' ' 95' ' ' GLN . 34.1 m -101.41 -6.05 9.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -170.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.577 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 57.3 mttp -52.62 -65.02 0.63 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.524 0.678 . . . . 0.0 110.752 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.661 ' OE2' ' HD3' ' A' ' 144' ' ' ARG . 34.9 mt-10 -86.75 -5.06 59.23 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.84 -175.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.515 ' HB3' ' HA ' ' A' ' 92' ' ' VAL . 8.6 tt0 -80.98 -47.36 13.74 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.489 175.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 53.3 t -65.9 -38.21 81.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.35 176.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.754 ' HG3' ' CH2' ' A' ' 133' ' ' TRP . 1.0 OUTLIER -61.81 -43.79 98.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.07 177.655 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -56.46 -44.93 81.0 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.175 0.512 . . . . 0.0 110.304 175.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -62.56 -43.39 98.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.562 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.83 80.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.139 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 69.2 mt -63.3 -43.57 97.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.585 177.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.426 ' HA ' HD21 ' A' ' 152' ' ' LEU . 76.5 ttt180 -62.79 -42.89 99.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.035 177.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.662 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -59.02 -45.3 91.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.609 177.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.618 ' HA ' HG21 ' A' ' 37' ' ' ILE . 37.2 ttmt -56.38 -58.84 6.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.297 -179.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.437 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 91.7 m-85 -80.09 -42.56 23.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -172.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -74.83 -22.51 58.66 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.982 -0.449 . . . . 0.0 111.497 -172.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.662 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.2 OUTLIER -83.5 -37.72 22.72 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.923 176.224 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.414 ' CE1' ' HE3' ' A' ' 35' ' ' TRP . 78.6 m-70 -98.36 104.56 16.61 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.77 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.79 -30.0 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.67 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -56.33 -52.04 66.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.543 0.687 . . . . 0.0 110.008 176.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 40.0 mt -78.87 -31.47 45.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.442 -176.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.735 ' HG3' HD12 ' A' ' 156' ' ' LEU . 18.9 ttt180 -63.03 -43.88 97.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.128 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.34 -35.64 78.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.444 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.442 HD12 ' HB2' ' A' ' 5' ' ' ALA . 36.1 tp -64.82 -42.82 94.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.404 178.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.487 HD21 HD13 ' A' ' 156' ' ' LEU . 61.0 tp -62.36 -41.2 98.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.209 0.528 . . . . 0.0 110.726 178.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 87.1 mt -77.7 -14.12 59.7 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.976 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -81.1 -34.61 32.48 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.544 176.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 22.9 p -75.14 -11.92 60.19 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.213 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.446 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -57.38 134.59 81.6 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.502 174.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.2 Cg_endo -106.24 69.37 0.23 Allowed 'Cis proline' 0 C--N 1.354 0.817 0 CA-C-N 118.917 0.649 . . . . 0.0 113.112 -5.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -88.85 158.4 18.12 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -88.19 105.95 17.87 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 176.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 29.5 mt -81.09 119.14 23.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.126 -173.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.524 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 47.3 t -134.95 123.6 41.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.9 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -98.85 137.09 37.92 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 172.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.415 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 81.1 t60 -98.91 77.56 2.22 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -177.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.413 ' C ' ' H ' ' A' ' 129' ' ' ASN . 5.7 t -100.01 94.98 6.55 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 122.298 1.047 . . . . 0.0 111.649 -173.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.478 ' HB3' ' HA3' ' A' ' 137' ' ' GLY . 3.0 pt-20 -83.27 14.36 3.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.894 170.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.413 ' H ' ' C ' ' A' ' 127' ' ' THR . 48.3 t-20 -82.37 -51.92 7.4 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.489 -1.232 . . . . 0.0 108.886 173.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -144.46 108.38 4.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.804 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.3 85.91 4.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.996 0.427 . . . . 0.0 111.182 -177.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.571 ' O ' ' HB3' ' A' ' 142' ' ' LYS . 35.5 t80 -169.17 -28.41 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.659 177.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.754 ' CH2' ' HG3' ' A' ' 97' ' ' MET . 47.3 m95 -111.8 77.22 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.529 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 112.39 -140.43 16.23 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 -178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -86.53 133.02 33.77 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 117.03 0.415 . . . . 0.0 110.222 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -84.55 32.33 3.4 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.127 -0.559 . . . . 0.0 112.804 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.478 ' HA3' ' HB3' ' A' ' 128' ' ' GLU . . . 80.95 13.45 81.2 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 121.185 -0.531 . . . . 0.0 114.091 174.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -154.35 12.15 0.41 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.955 0.877 . . . . 0.0 112.744 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 98.86 5.37 56.55 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 121.042 -0.599 . . . . 0.0 114.096 172.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -167.32 97.27 0.5 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 117.257 0.529 . . . . 0.0 111.253 176.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.33 -64.91 0.2 Allowed Glycine 0 C--N 1.31 -0.863 0 C-N-CA 120.481 -0.866 . . . . 0.0 111.332 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.571 ' HB3' ' O ' ' A' ' 132' ' ' TYR . 37.6 tttm -177.96 83.86 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.27 5.28 0.57 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.187 -174.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.661 ' HD3' ' OE2' ' A' ' 94' ' ' GLU . 51.2 ttt180 -62.48 -24.13 67.3 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -175.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.744 HD23 ' HB3' ' A' ' 133' ' ' TRP . 31.1 tp -58.57 -50.77 72.6 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 175.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.574 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -66.52 -28.62 73.84 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.925 176.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -68.78 -38.7 80.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.755 0.312 . . . . 0.0 110.328 177.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 96.3 mt -61.16 -37.55 83.28 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 174.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.9 -37.88 89.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.511 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.574 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 58.2 mtt -63.0 -51.77 65.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.875 0.369 . . . . 0.0 110.166 176.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -59.11 -44.41 91.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.459 -178.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.518 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 55.7 tp -67.11 -40.24 86.83 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.009 178.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.797 ' HB3' HH11 ' A' ' 153' ' ' ARG . 1.4 ttp-105 -57.8 -43.56 85.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.465 -179.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.18 -46.42 82.84 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.278 175.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.0 -51.39 69.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.518 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.735 HD12 ' HG3' ' A' ' 112' ' ' ARG . 20.9 mt -63.33 -30.78 71.85 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.909 -175.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.418 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -69.0 -48.15 63.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.324 175.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 162' ' ' GLU . 81.7 mt -64.01 -39.05 84.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.202 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -56.11 -47.21 78.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.978 0.418 . . . . 0.0 110.552 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -84.05 -15.95 45.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.117 0.484 . . . . 0.0 110.418 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 14.4 tp -72.38 -19.06 61.68 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 175.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 158' ' ' ILE . 42.0 mt-10 -74.64 10.83 1.2 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.998 176.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -57.69 94.83 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.57 0.7 . . . . 0.0 111.591 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -114.87 90.67 3.4 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.308 0.575 . . . . 0.0 110.888 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 63.74 12.06 6.34 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.401 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 22.8 t-160 -63.2 -42.69 99.35 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 176.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -137.95 -38.84 0.56 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 168.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 . . . . . 0 C--O 1.247 0.968 0 CA-C-N 114.637 -1.165 . . . . 0.0 108.521 177.544 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.6 mtt . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.567 -0.16 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -66.6 -44.85 5.52 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.226 1.951 . . . . 0.0 110.141 171.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 20.4 t -103.6 100.97 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.68 173.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -87.39 101.03 13.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.887 0.375 . . . . 0.0 111.013 -173.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.78 124.88 30.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.263 177.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -149.96 149.91 31.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.755 0.312 . . . . 0.0 110.362 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 17.4 mtm180 -89.7 121.45 31.88 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.091 -175.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.9 tt -98.66 114.25 35.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.48 0.657 . . . . 0.0 109.318 169.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.13 168.51 16.68 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.856 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.1 m170 59.55 59.68 2.51 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -173.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.1 m -83.46 15.27 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.727 -173.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 38.5 mtm 63.94 40.9 6.98 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.537 171.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 70.43 -69.4 0.18 Allowed 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.709 0.631 . . . . 0.0 111.733 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -140.18 87.78 2.17 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.61 -174.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.4 t -101.65 142.08 33.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.119 176.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.421 ' N ' HD13 ' A' ' 16' ' ' ILE . 4.0 mp -96.15 105.61 17.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.4 mt -89.85 115.26 29.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.034 0.445 . . . . 0.0 110.347 -175.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.459 ' N ' HD21 ' A' ' 18' ' ' ASN . 0.9 OUTLIER -93.93 108.68 20.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.43 -177.22 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 31.4 p90 -114.25 113.79 25.09 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.086 0.47 . . . . 0.0 110.394 177.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.502 ' O ' ' HB2' ' A' ' 21' ' ' SER . 16.9 t80 -150.17 100.22 2.88 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 174.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.502 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 33.8 t 161.34 115.58 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.23 0 O-C-N 124.205 0.941 . . . . 0.0 109.008 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 m -87.94 2.47 51.56 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.241 0.543 . . . . 0.0 110.245 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.9 m -110.1 20.03 18.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.05 -177.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -126.29 157.63 37.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.966 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.91 -33.06 74.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.868 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -87.62 -1.52 58.01 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.6 0.714 . . . . 0.0 109.86 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.25 -0.29 56.61 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.261 -177.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.487 ' CG ' ' HZ2' ' A' ' 104' ' ' LYS . 23.1 t70 -51.69 -30.74 23.28 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -72.9 -0.79 14.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.734 0.302 . . . . 0.0 111.701 -177.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.9 t -75.06 139.78 43.05 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -77.63 -3.2 39.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.004 0.431 . . . . 0.0 110.573 178.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -106.77 12.01 29.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.37 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.2 137.14 57.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.855 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.94 58.18 2.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.297 0.57 . . . . 0.0 111.595 -174.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -112.0 118.81 45.62 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.966 177.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.78 134.53 35.2 Favored 'Trans proline' 0 C--O 1.239 0.534 0 C-N-CA 122.624 2.216 . . . . 0.0 111.501 175.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.549 HG21 ' HA ' ' A' ' 104' ' ' LYS . 29.8 pt -121.85 155.84 26.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.101 0.477 . . . . 0.0 110.925 -176.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.526 ' HE2' ' HA2' ' A' ' 41' ' ' GLY . 1.2 tmtp? -117.31 107.07 13.95 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 -178.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.426 ' C ' ' H ' ' A' ' 41' ' ' GLY . 7.7 t -127.21 127.88 69.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.072 -173.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 27.6 t70 73.64 -19.94 0.32 Allowed 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.712 0.633 . . . . 0.0 111.84 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.526 ' HA2' ' HE2' ' A' ' 38' ' ' LYS . . . 125.79 1.86 7.47 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 -171.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -109.52 134.98 51.25 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.241 -0.48 . . . . 0.0 110.1 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.3 m -84.17 116.5 22.95 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.167 176.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.451 ' HB2' HG13 ' A' ' 37' ' ' ILE . 80.0 m95 -106.06 130.74 22.51 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.837 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.65 -26.16 69.02 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.695 2.263 . . . . 0.0 112.945 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.803 ' HB ' ' OE1' ' A' ' 48' ' ' GLU . 0.1 OUTLIER -159.71 173.7 15.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.329 -178.044 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.0 m -77.87 -48.34 16.65 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -171.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.803 ' OE1' ' HB ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -59.94 -25.97 65.59 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.178 -178.844 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.522 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 54.3 m80 -59.82 -43.4 94.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.005 176.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -67.22 -44.69 78.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.945 0.402 . . . . 0.0 110.074 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -60.87 -46.59 90.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.638 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.456 ' CG ' ' HA3' ' A' ' 78' ' ' GLY . 2.4 tp-100 -65.08 -32.4 74.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.809 -177.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -73.74 -46.06 48.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.53 -178.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -77.83 -9.54 59.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.181 0.515 . . . . 0.0 110.756 -177.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.412 ' HA ' ' CZ3' ' A' ' 89' ' ' TRP . 86.8 tttt -63.43 -29.17 70.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.045 175.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -109.17 167.09 10.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.78 -177.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.425 HD13 ' HG2' ' A' ' 86' ' ' ARG . 5.2 mp -96.57 -37.19 10.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.934 -176.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.544 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 24.5 t70 -63.38 126.63 28.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.822 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.63 -32.37 67.88 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -173.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.8 ttpp -64.35 -40.9 96.77 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.456 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 0.5 OUTLIER -66.45 -32.25 73.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.712 -179.628 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.544 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 65.0 mtt180 -63.67 -45.2 91.21 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.368 0.604 . . . . 0.0 109.556 176.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -77.59 -16.36 58.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.386 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.456 ' HB2' ' HA ' ' A' ' 61' ' ' TYR . 6.3 tp10 -66.82 -45.81 77.13 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.523 ' O ' HG13 ' A' ' 68' ' ' VAL . 1.9 mp -70.79 -31.4 45.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.731 175.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -72.57 -11.54 60.69 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.009 0.433 . . . . 0.0 110.644 175.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -85.24 -7.95 58.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.132 0.491 . . . . 0.0 110.402 -177.901 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.523 HG13 ' O ' ' A' ' 65' ' ' ILE . 7.5 p -115.36 138.43 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.792 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 39.3 t -90.35 -32.41 16.48 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.798 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.44 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 31.4 t -68.71 121.41 81.06 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.708 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.522 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 22.4 Cg_exo -66.05 -32.83 43.15 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.121 2.547 . . . . 0.0 112.26 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 46.3 ttm -67.8 -41.44 83.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.696 -177.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.505 ' HB ' HG23 ' A' ' 68' ' ' VAL . 87.1 t -66.3 -36.2 76.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.447 178.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.43 -44.28 95.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.247 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.412 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -63.44 -39.43 94.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.73 177.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -56.51 -53.84 52.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.693 178.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 54.0 mtm -70.56 -30.54 67.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.914 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.456 ' HA3' ' CG ' ' A' ' 52' ' ' GLN . . . -81.95 -7.22 88.19 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.943 -178.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 40.9 ttt180 -89.24 -0.94 57.85 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 122.539 -0.389 . . . . 0.0 110.627 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.431 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 30.2 t70 -71.12 112.38 7.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.047 0.451 . . . . 0.0 110.499 -179.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -96.16 10.82 36.5 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.325 0.583 . . . . 0.0 110.16 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 m -74.13 -24.4 59.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.643 176.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.431 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 49.2 mmtm -75.78 147.0 80.62 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.576 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -62.51 120.58 8.18 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.319 2.013 . . . . 0.0 111.215 173.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 89.4 mt -86.74 150.95 23.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.804 -176.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.553 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 22.7 mtp180 -68.83 130.63 43.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.36 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -58.06 -43.09 86.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.976 0.417 . . . . 0.0 111.603 -177.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -103.32 33.23 3.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.835 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.553 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 43.8 t-105 -60.09 -40.11 88.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.776 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.447 ' HA ' ' HE3' ' A' ' 93' ' ' LYS . 12.4 pt-20 -68.23 -23.38 64.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.697 0.284 . . . . 0.0 111.211 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.0 m -84.38 -20.15 32.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.15 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.6 m -114.3 6.99 7.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 110.607 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.447 ' HE3' ' HA ' ' A' ' 90' ' ' GLU . 38.4 ttmt -58.78 -53.01 63.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.649 -176.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -25.5 49.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.469 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.794 ' HA ' ' HD2' ' A' ' 98' ' ' ARG . 34.0 tt0 -58.68 -56.06 27.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.631 174.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.9 -43.99 96.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.823 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 47.0 ttm -65.05 -43.92 90.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.774 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.794 ' HD2' ' HA ' ' A' ' 95' ' ' GLN . 0.8 OUTLIER -66.65 -29.32 69.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.441 -178.535 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.44 ' N ' ' HG2' ' A' ' 98' ' ' ARG . 88.3 tttt -71.12 -42.79 68.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.021 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.62 87.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.428 176.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' A' ' 101' ' ' LEU . 22.4 mt -60.91 -41.76 96.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.227 178.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.664 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 58.4 ttt180 -61.01 -48.65 80.83 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 120.383 -0.527 . . . . 0.0 109.882 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -55.9 -36.69 67.94 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.115 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.549 ' HA ' HG21 ' A' ' 37' ' ' ILE . 63.5 tttm -59.21 -50.61 73.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.171 178.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -81.79 -26.21 34.6 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -177.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.664 ' HG3' ' HG2' ' A' ' 102' ' ' ARG . 5.9 mm-40 -74.98 -35.79 62.04 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.729 0.3 . . . . 0.0 111.759 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.51 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 77.2 mm-40 -84.21 -11.46 56.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.985 0.422 . . . . 0.0 110.905 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -129.2 99.21 5.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.811 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -59.67 -29.9 68.39 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.486 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.452 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.9 mp0 -53.26 -51.79 61.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.074 175.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.49 HD13 ' HZ3' ' A' ' 104' ' ' LYS . 29.0 mt -75.42 -33.7 60.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.48 -176.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 24.6 ttt-85 -57.96 -41.77 83.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.114 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.7 -43.12 73.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.792 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 63.7 tp -57.11 -44.28 83.11 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.784 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.424 HD23 HD13 ' A' ' 156' ' ' LEU . 40.5 tp -62.76 -45.89 90.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.274 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.502 HD21 ' HB2' ' A' ' 156' ' ' LEU . 79.0 mt -70.37 -18.28 63.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.719 0.295 . . . . 0.0 111.629 -176.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -73.9 -21.9 59.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.631 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.1 p -75.67 -27.28 58.26 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -176.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.526 ' HB1' ' HD2' ' A' ' 153' ' ' ARG . . . -48.78 137.78 12.76 Favored Pre-proline 0 N--CA 1.467 0.379 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -100.75 33.74 8.3 Favored 'Cis proline' 0 N--CA 1.458 -0.588 0 C-N-CA 124.554 -1.019 . . . . 0.0 112.941 -2.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -62.84 159.42 16.65 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.976 0.417 . . . . 0.0 111.688 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -90.5 119.05 30.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.114 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.407 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 60.5 mt -86.4 113.48 22.39 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.757 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 95.7 t -131.9 126.8 57.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.084 0.469 . . . . 0.0 111.285 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.562 ' OE1' ' HA3' ' A' ' 134' ' ' GLY . 0.0 OUTLIER -83.31 141.73 31.6 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 172.777 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -120.04 77.51 1.25 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.374 -174.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.435 ' HG1' ' CD ' ' A' ' 125' ' ' GLU . 2.2 m -78.33 137.49 38.08 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.601 171.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 45.6 mp0 -120.49 -1.36 10.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.74 0.305 . . . . 0.0 110.658 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -94.57 -5.43 45.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.885 0.374 . . . . 0.0 111.297 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.785 ' O ' ' HA2' ' A' ' 136' ' ' GLY . 4.8 t70 -178.48 -165.01 0.08 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.06 86.2 2.23 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.88 0.371 . . . . 0.0 110.133 175.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.528 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 4.7 t80 -155.13 122.29 5.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.584 -175.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.436 ' HZ2' ' HG2' ' A' ' 93' ' ' LYS . 28.8 m95 64.03 20.62 12.28 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.78 0.675 . . . . 0.0 112.513 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.562 ' HA3' ' OE1' ' A' ' 125' ' ' GLU . . . -176.01 -114.85 0.39 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.232 -0.985 . . . . 0.0 112.279 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -112.79 173.14 6.52 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 120.698 0.285 . . . . 0.0 110.794 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.785 ' HA2' ' O ' ' A' ' 130' ' ' ASP . . . -120.95 21.11 8.42 Favored Glycine 0 N--CA 1.444 -0.821 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 175.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.6 44.12 4.99 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.425 -0.417 . . . . 0.0 113.26 178.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -174.15 -35.34 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 117.164 0.482 . . . . 0.0 112.207 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 131.01 36.41 0.35 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.893 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt 179.32 89.99 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.816 0.341 . . . . 0.0 110.804 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.575 ' O ' ' HG3' ' A' ' 142' ' ' LYS . . . -123.93 -65.13 0.2 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 119.664 -1.255 . . . . 0.0 112.124 174.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 141' ' ' GLY . 47.6 mttp -166.17 79.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 123.697 0.799 . . . . 0.0 109.2 177.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.1 4.99 2.32 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.511 -173.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.679 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 6.9 tpp180 -49.63 -38.64 32.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.226 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.56 -58.5 7.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.962 -178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 123' ' ' LEU . . . -62.49 -29.88 74.8 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.945 -0.645 . . . . 0.0 111.752 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . 0.416 ' O ' ' HG2' ' A' ' 151' ' ' GLU . 11.4 t80 -67.21 -40.67 86.45 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.679 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.1 mt -61.06 -41.49 96.7 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.895 0.379 . . . . 0.0 110.174 175.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.8 mt -61.15 -36.76 80.64 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.863 177.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 77.8 mtm -77.58 -34.78 53.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.972 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 147' ' ' TYR . 7.3 mm-40 -59.72 -48.26 82.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.457 0.646 . . . . 0.0 109.48 172.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.517 HD13 ' HG3' ' A' ' 102' ' ' ARG . 54.3 tp -64.56 -37.63 88.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.793 179.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.665 HH11 ' HG2' ' A' ' 153' ' ' ARG . 30.9 ttp85 -61.04 -41.34 96.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.988 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -67.28 -33.95 76.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.084 0.468 . . . . 0.0 110.461 176.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -65.32 -53.18 47.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.901 177.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 55.2 mt -68.0 -23.59 65.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.93 -175.029 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.507 ' O ' ' HB3' ' A' ' 160' ' ' LYS . . . -64.43 -48.81 73.92 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.494 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.08 -37.42 80.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.771 0.319 . . . . 0.0 110.616 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.69 -24.19 66.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.019 0.438 . . . . 0.0 110.725 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.507 ' HB3' ' O ' ' A' ' 157' ' ' ALA . 53.3 tttp -68.1 -26.73 65.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.257 176.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.4 mp -78.64 -35.69 45.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.248 0.547 . . . . 0.0 109.935 176.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -84.43 11.54 8.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.435 -178.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 4.8 p80 -62.75 -15.99 55.78 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.737 0.303 . . . . 0.0 110.932 -178.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -60.84 112.1 1.91 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.22 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.651 ' HD2' ' HB3' ' A' ' 168' ' ' HIS . 10.0 t-160 59.94 24.16 13.27 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.06 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 27.9 t60 -76.19 -25.58 55.33 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 63.7 t-80 -147.03 93.26 2.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.462 172.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.651 ' HB3' ' HD2' ' A' ' 165' ' ' HIS . 36.7 t60 . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.727 -0.654 . . . . 0.0 109.357 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 120.736 0.303 . . . . 0.0 110.479 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -87.6 150.1 7.51 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 122.821 2.348 . . . . 0.0 113.202 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.7 p -167.17 94.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.902 0.858 . . . . 0.0 109.988 175.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.513 ' HB3' ' CG ' ' A' ' 25' ' ' ASP . 42.3 ttm105 -105.6 37.89 2.12 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.772 0.796 . . . . 0.0 110.195 -176.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.422 ' HB2' HD11 ' A' ' 114' ' ' LEU . . . -78.37 29.4 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.2 -176.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -122.55 25.47 8.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.785 0.326 . . . . 0.0 110.789 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -75.02 -52.88 9.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.516 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 68.5 mt -105.55 111.27 34.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.437 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -89.49 85.81 6.61 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.691 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 65.23 118.12 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.332 0.587 . . . . 0.0 111.588 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.54 HG22 ' HB3' ' A' ' 121' ' ' ALA . 34.4 m -68.59 163.14 3.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.542 176.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.428 ' SD ' ' N ' ' A' ' 12' ' ' MET . 0.0 OUTLIER -81.2 -79.9 0.15 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.814 -173.831 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.0 tp60 -171.46 119.74 0.47 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.391 -0.822 . . . . 0.0 108.925 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.8 t70 59.58 88.11 0.08 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.596 0.713 . . . . 0.0 110.198 -172.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.534 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 9.2 m -134.44 117.02 15.82 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.582 -179.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.452 ' N ' HD12 ' A' ' 16' ' ' ILE . 4.2 mp -82.95 100.77 6.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.458 HD13 HG12 ' A' ' 11' ' ' VAL . 62.9 mt -89.81 108.75 19.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.266 -177.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.608 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 0.9 OUTLIER -92.81 106.64 18.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.598 179.436 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.64 ' CE2' ' HB2' ' A' ' 125' ' ' GLU . 39.6 p90 -105.02 151.33 24.08 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 174.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.659 ' CE1' ' HA ' ' A' ' 127' ' ' THR . 1.7 t80 -150.1 108.04 3.72 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.436 -0.505 . . . . 0.0 111.923 -176.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.7 m 73.68 171.14 0.3 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.614 0.721 . . . . 0.0 112.247 173.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.0 p -82.43 3.05 29.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.997 -1.001 . . . . 0.0 112.222 -172.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.7 p -76.12 23.39 0.14 Allowed 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -174.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -156.92 163.66 38.9 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 -178.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.513 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 5.7 m-20 -61.24 -35.71 77.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.264 0.554 . . . . 0.0 109.901 175.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.429 ' CE1' HD13 ' A' ' 114' ' ' LEU . 92.2 m-85 -77.74 -1.95 33.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.354 177.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.27 -4.15 67.8 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.08 177.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.521 ' CG ' ' HZ3' ' A' ' 104' ' ' LYS . 24.2 t70 -68.78 -22.85 64.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.423 0.63 . . . . 0.0 110.093 174.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -68.5 -24.86 64.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.475 176.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.0 m -71.98 134.11 45.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.739 175.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.482 ' HB2' ' HE2' ' A' ' 97' ' ' MET . 5.0 p30 -54.97 -23.63 20.14 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -174.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.62 -52.96 17.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 176.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 42.25 -157.2 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.863 0.865 . . . . 0.0 112.992 -176.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -157.86 22.63 0.27 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.737 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 84.1 m95 -112.99 125.58 29.58 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.935 -177.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 24.5 Cg_exo -64.38 143.24 82.04 Favored 'Trans proline' 0 C--O 1.238 0.485 0 C-N-CA 122.844 2.363 . . . . 0.0 112.41 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.609 HG21 ' HA ' ' A' ' 104' ' ' LYS . 32.2 pt -121.92 153.0 25.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.523 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.415 ' HE3' ' O ' ' A' ' 41' ' ' GLY . 37.9 tptt -116.17 95.43 5.08 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 t -107.81 117.42 53.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.291 -178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.6 t70 69.13 5.01 4.84 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.584 0.707 . . . . 0.0 110.632 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.415 ' O ' ' HE3' ' A' ' 38' ' ' LYS . . . 104.67 -2.34 42.18 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.469 -175.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 51.6 mttm -94.25 125.45 38.89 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.631 ' HB ' HH21 ' A' ' 66' ' ' ARG . 35.2 m -82.82 109.72 17.21 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.863 0.363 . . . . 0.0 110.602 178.073 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.426 ' HB2' ' CG1' ' A' ' 37' ' ' ILE . 57.6 m95 -101.84 129.04 27.37 Favored Pre-proline 0 C--N 1.318 -0.773 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 174.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.458 ' CG ' ' HA ' ' A' ' 69' ' ' SER . 52.4 Cg_exo -53.78 -22.57 23.77 Favored 'Trans proline' 0 N--CA 1.475 0.431 0 C-N-CA 123.026 2.484 . . . . 0.0 113.338 -176.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 15.4 t -179.31 173.37 1.12 Allowed 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 175.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.73 -32.57 71.83 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -175.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -50.02 -43.37 50.68 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.559 0.343 . . . . 0.0 111.335 175.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -69.13 -30.13 68.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.168 -175.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -76.02 -31.65 59.0 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -64.02 -52.38 59.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.948 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -63.6 -41.03 98.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.653 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.796 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -67.04 -27.69 67.61 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -100.49 -7.15 24.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.657 0.265 . . . . 0.0 110.988 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.538 ' HA ' ' CZ3' ' A' ' 89' ' ' TRP . 83.2 tttt -62.62 -39.59 94.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.333 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -107.36 160.79 15.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.115 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.667 HD21 ' H ' ' A' ' 57' ' ' LEU . 1.6 pt? -95.73 28.9 2.84 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 168.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -97.68 106.58 18.91 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.105 -1.407 . . . . 0.0 109.895 -176.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.476 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 2.4 mp0 -64.69 -35.8 82.2 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.346 -178.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -63.79 -47.6 80.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.797 0.332 . . . . 0.0 110.809 -177.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.532 ' O ' HG12 ' A' ' 65' ' ' ILE . 0.1 OUTLIER -68.77 -29.55 67.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.367 -178.145 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.796 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 38.4 ttm180 -60.99 -41.9 97.38 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.127 0.489 . . . . 0.0 109.754 176.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 45.0 mt-10 -65.7 -39.51 91.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.117 176.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.26 -36.99 63.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.154 -174.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 61' ' ' TYR . 41.1 mm -63.56 -33.47 61.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 174.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.631 HH21 ' HB ' ' A' ' 43' ' ' THR . 0.4 OUTLIER -73.25 -25.31 60.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.271 178.04 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 58.0 mtt-85 -70.28 -33.24 71.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.643 0.259 . . . . 0.0 111.204 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.4 m -92.29 134.88 29.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.239 0.542 . . . . 0.0 111.417 -175.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.458 ' HA ' ' CG ' ' A' ' 45' ' ' PRO . 5.0 p -88.78 -21.32 23.85 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.479 175.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 44.5 t -78.47 126.18 83.42 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.741 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -72.34 -32.29 10.46 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.636 2.224 . . . . 0.0 112.008 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.9 tpt -69.82 -38.36 76.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.266 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 95.5 t -68.32 -39.09 80.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.565 177.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.98 -52.2 57.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.658 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.14 -35.77 74.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.044 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 30.5 ttt85 -62.33 -39.98 94.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.742 0.306 . . . . 0.0 110.689 177.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.439 ' HE3' HD11 ' A' ' 65' ' ' ILE . 72.4 mtm -74.02 -34.93 64.32 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.03 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.49 6.37 77.74 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.469 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -63.25 -42.3 99.16 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -86.95 176.9 7.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.831 0.348 . . . . 0.0 111.482 -170.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -115.18 5.42 14.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.046 -174.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 49.9 m -64.75 -27.3 68.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.884 0.373 . . . . 0.0 111.294 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.491 ' HE3' ' CE2' ' A' ' 61' ' ' TYR . 0.2 OUTLIER -89.49 147.22 37.48 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -50.27 112.55 0.76 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.164 2.576 . . . . 0.0 113.97 -173.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 97.0 mt -88.47 155.17 19.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.023 175.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 -95.76 143.77 26.71 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.747 0.308 . . . . 0.0 110.497 -178.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -79.45 -28.64 41.62 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.177 0.513 . . . . 0.0 110.28 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -85.47 11.9 9.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.621 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.538 ' CZ3' ' HA ' ' A' ' 55' ' ' LYS . 60.7 t-105 -60.39 -19.45 55.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.333 0.587 . . . . 0.0 110.138 176.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.597 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 17.9 mm-40 -68.11 -40.38 82.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.488 175.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.0 p -100.02 -1.0 38.12 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -172.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.476 HG23 ' HA ' ' A' ' 89' ' ' TRP . 34.7 m -112.37 0.8 8.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -177.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.597 ' NZ ' ' HA ' ' A' ' 90' ' ' GLU . 50.7 mttp -61.04 -54.92 38.83 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.286 0.565 . . . . 0.0 109.944 179.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -67.74 -28.66 67.83 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.471 -178.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -69.94 -54.09 14.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.744 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.4 t -62.22 -43.99 98.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.636 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.482 ' HE2' ' HB2' ' A' ' 31' ' ' ASN . 0.8 OUTLIER -60.09 -50.15 74.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.886 178.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.5 ttm-85 -60.01 -43.11 95.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.899 0.381 . . . . 0.0 110.866 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -66.48 -48.01 71.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.919 -178.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.11 -37.98 89.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.88 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.417 HD13 ' CD2' ' A' ' 149' ' ' LEU . 90.0 mt -67.5 -43.06 81.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.107 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.515 ' HG3' HD11 ' A' ' 152' ' ' LEU . 10.9 ttt-85 -61.55 -46.55 89.46 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.956 178.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.521 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -63.91 -24.48 67.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.097 -179.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.609 ' HA ' HG21 ' A' ' 37' ' ' ILE . 28.1 ttpp -76.74 -49.6 15.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.547 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.585 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 77.4 m-85 -71.6 -27.55 63.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.327 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.425 ' HA ' HH11 ' A' ' 112' ' ' ARG . 25.6 mt-10 -73.83 -35.4 64.84 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.613 173.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 7.8 tp-100 -66.81 -34.66 78.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.061 -177.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.445 ' HB3' ' OE2' ' A' ' 110' ' ' GLU . 97.0 m-70 -121.4 109.59 15.06 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.459 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.76 -33.25 73.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.778 -177.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.445 ' OE2' ' HB3' ' A' ' 108' ' ' HIS . 1.0 OUTLIER -72.44 -29.9 64.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.77 -179.044 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 76.2 mt -74.61 -38.64 62.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.04 0.447 . . . . 0.0 109.893 175.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.585 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 30.6 ttp-105 -62.89 -43.53 98.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.045 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.69 72.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.722 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.429 HD13 ' CE1' ' A' ' 26' ' ' TYR . 66.4 tp -66.27 -48.17 71.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.943 0.401 . . . . 0.0 110.257 176.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.464 HD21 HD12 ' A' ' 156' ' ' LEU . 42.7 tp -59.41 -44.89 92.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.013 178.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 51.3 mt -74.94 -15.96 60.66 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.476 -177.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.3 -21.14 56.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.894 0.378 . . . . 0.0 110.752 176.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 43.8 p -85.97 -5.95 59.13 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 121.05 0.453 . . . . 0.0 110.559 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.07 143.21 65.3 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.282 174.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -99.34 46.56 2.36 Favored 'Cis proline' 0 N--CA 1.456 -0.687 0 C-N-CA 124.397 -1.085 . . . . 0.0 113.56 -0.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.54 ' HB3' HG22 ' A' ' 11' ' ' VAL . . . -78.73 176.53 9.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.588 0.232 . . . . 0.0 110.761 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.403 ' HG3' ' SD ' ' A' ' 150' ' ' MET . 35.1 ttpt -108.69 127.82 54.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.271 -176.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 27.8 mt -93.16 120.46 33.48 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.27 -172.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.608 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 99.0 t -139.42 120.3 15.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.047 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.64 ' HB2' ' CE2' ' A' ' 19' ' ' PHE . 31.8 tt0 -93.88 129.86 40.15 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 172.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.463 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 8.4 t60 -97.63 77.6 2.58 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -176.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.659 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -77.17 92.22 3.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.065 -179.859 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.408 ' HB2' ' HD2' ' A' ' 126' ' ' HIS . 20.3 tt0 -95.53 -15.01 23.16 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.225 -174.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -88.61 -34.08 17.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.542 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.531 ' O ' ' HB ' ' A' ' 127' ' ' THR . 34.3 t70 -142.19 110.28 5.93 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.101 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.514 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -79.09 85.94 4.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.919 -172.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.495 ' CE2' ' HD3' ' A' ' 142' ' ' LYS . 7.4 t80 -169.55 147.36 3.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.522 172.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.48 ' HB3' HD21 ' A' ' 145' ' ' LEU . 18.5 m95 68.53 13.6 8.97 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 123.746 0.654 . . . . 0.0 111.693 178.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -160.44 -155.59 7.83 Favored Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 119.929 -1.129 . . . . 0.0 112.71 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.463 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 15.3 t70 -66.43 -29.02 69.07 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.224 0.535 . . . . 0.0 110.696 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.612 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 78.06 0.41 76.2 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.62 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.43 ' HA2' ' NE2' ' A' ' 126' ' ' HIS . . . 88.26 9.37 70.13 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.491 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -170.3 25.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 111.186 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 86.54 -51.97 4.41 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.288 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -88.67 65.25 7.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.3 0.572 . . . . 0.0 111.119 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.612 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -123.32 14.49 8.25 Favored Glycine 0 C--N 1.315 -0.616 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.379 173.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.495 ' HD3' ' CE2' ' A' ' 132' ' ' TYR . 22.2 mtpp 61.36 79.9 0.24 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.211 0.604 . . . . 0.0 111.071 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -75.38 5.33 5.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.276 -176.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.655 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 1.2 ttm180 -32.76 -37.42 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.43 1.092 . . . . 0.0 112.665 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 133' ' ' TRP . 45.4 tp -61.37 -52.65 63.76 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.611 0.243 . . . . 0.0 111.126 -178.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -63.17 -27.01 69.88 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.701 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . 0.489 ' HA ' ' HE1' ' A' ' 150' ' ' MET . 70.9 t80 -71.33 -43.34 67.2 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.655 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 75.1 mt -61.71 -41.21 97.3 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 175.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.417 ' CD2' HD13 ' A' ' 101' ' ' LEU . 60.8 mt -61.3 -38.83 88.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.813 175.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.489 ' HE1' ' HA ' ' A' ' 147' ' ' TYR . 62.4 mtm -70.09 -38.95 75.82 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.212 178.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.0 -46.13 90.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.026 0.441 . . . . 0.0 109.887 174.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.515 HD11 ' HG3' ' A' ' 102' ' ' ARG . 45.7 tp -63.29 -42.06 99.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.642 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.926 ' HB3' HH11 ' A' ' 153' ' ' ARG . 1.0 OUTLIER -60.01 -42.49 94.39 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.672 176.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.63 -44.68 93.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.226 0.536 . . . . 0.0 109.858 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -65.12 -41.42 94.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.143 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.464 HD12 HD21 ' A' ' 115' ' ' LEU . 79.3 mt -76.28 -22.57 54.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.706 -0.225 . . . . 0.0 110.569 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -67.24 -44.37 79.63 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 172.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 75.2 mt -63.6 -40.12 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.876 174.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -63.52 -32.42 73.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.217 177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.454 ' O ' ' HD2' ' A' ' 163' ' ' HIS . 27.7 tptp -74.58 -44.07 52.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.795 176.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.12 -16.93 49.68 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.641 175.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.418 ' O ' ' N ' ' A' ' 164' ' ' HIS . 0.7 OUTLIER -79.1 11.61 2.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.544 177.319 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.454 ' HD2' ' O ' ' A' ' 160' ' ' LYS . 22.9 p80 -54.4 76.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.72 0.771 . . . . 0.0 111.547 171.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . 0.418 ' N ' ' O ' ' A' ' 162' ' ' GLU . 31.9 m80 -147.64 173.83 12.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.066 -178.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -105.62 76.14 1.18 Allowed 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 159.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -52.67 -47.8 66.94 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.04 -1.436 . . . . 0.0 111.596 -169.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -137.81 -29.81 0.84 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.504 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 74.6 t60 . . . . . 0 C--O 1.245 0.862 0 CA-C-O 118.353 -0.832 . . . . 0.0 109.957 178.398 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.654 ' H1 ' ' HD2' ' A' ' 2' ' ' PRO . 44.4 tpp . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.654 ' HD2' ' H1 ' ' A' ' 1' ' ' MET . 71.5 Cg_endo -76.53 19.25 0.65 Allowed 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.938 1.759 . . . . 0.0 113.166 -179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.446 HG23 ' HB3' ' A' ' 110' ' ' GLU . 8.4 p 43.69 89.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 124.714 1.206 . . . . 0.0 113.187 178.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -101.66 -31.91 10.58 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.889 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 56.0 68.79 0.81 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.513 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -68.06 127.24 32.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.432 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.5 mtm-85 -98.7 141.13 31.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.547 -172.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.595 HD13 ' HA ' ' A' ' 118' ' ' THR . 64.5 mt -77.66 135.29 26.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.205 178.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -84.39 -48.22 9.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.104 0.478 . . . . 0.0 110.759 -178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -141.66 116.6 9.88 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.523 -176.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.721 HG21 ' HD2' ' A' ' 120' ' ' PRO . 9.0 m -89.65 163.83 2.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.452 ' HE1' ' HG1' ' A' ' 15' ' ' THR . 21.0 mtm -125.26 18.19 8.31 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.594 0.235 . . . . 0.0 110.791 -174.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' A' ' 15' ' ' THR . 27.1 mt-30 69.18 -60.21 0.46 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.168 -176.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -79.23 24.33 0.34 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.705 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.452 ' HG1' ' HE1' ' A' ' 12' ' ' MET . 11.8 m -83.13 103.25 12.4 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.311 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.535 HG12 ' HB3' ' A' ' 122' ' ' LYS . 28.4 mt -100.88 108.73 23.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 175.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -92.35 111.6 24.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.413 -174.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.615 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 16.8 m120 -99.61 116.46 31.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.076 -178.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.444 ' O ' ' HG3' ' A' ' 125' ' ' GLU . 28.8 p90 -112.36 174.44 5.88 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.238 178.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.404 ' C ' ' HG ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -142.16 100.57 3.75 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.094 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.404 ' HG ' ' C ' ' A' ' 20' ' ' TYR . 67.7 p 49.17 -144.39 0.46 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 123.778 0.674 . . . . 0.0 110.967 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.659 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 17.0 p -76.01 -77.16 0.14 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.45 -179.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.8 m 68.16 -61.09 0.4 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.107 0.563 . . . . 0.0 112.163 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.442 ' CG ' ' H ' ' A' ' 25' ' ' ASP . 9.5 t70 -132.04 -164.7 1.49 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -175.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.442 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 28.3 t70 -71.25 -20.05 62.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.458 0.647 . . . . 0.0 110.242 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -77.77 -5.66 51.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.505 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.659 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -71.28 -0.85 39.32 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.892 -0.595 . . . . 0.0 114.026 -174.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.41 -24.48 60.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.011 0.434 . . . . 0.0 111.658 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -66.1 -13.3 59.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.431 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.2 t -86.56 131.78 34.08 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 174.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -75.5 8.7 2.64 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -176.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -98.52 4.2 48.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.366 0.603 . . . . 0.0 109.636 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.14 138.0 49.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.474 177.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.426 ' HA ' ' CG2' ' A' ' 46' ' ' THR . . . -86.35 60.65 6.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.18 0.514 . . . . 0.0 111.613 -173.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -101.95 113.05 65.97 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.12 175.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.84 132.83 44.41 Favored 'Trans proline' 0 C--O 1.239 0.531 0 C-N-CA 122.776 2.318 . . . . 0.0 112.35 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.496 HG13 ' HB2' ' A' ' 44' ' ' TRP . 12.4 pt -126.11 130.34 72.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.523 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -86.78 98.68 11.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.417 177.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.0 t -126.16 129.13 72.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.97 -174.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 59.68 20.63 9.31 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.812 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 108.46 -14.26 35.89 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.584 -0.817 . . . . 0.0 113.551 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.6 tptm -124.79 161.84 25.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 117.938 0.869 . . . . 0.0 110.922 -172.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.5 m -96.71 115.44 27.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.898 0.38 . . . . 0.0 110.604 -177.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.496 ' HB2' HG13 ' A' ' 37' ' ' ILE . 67.4 m95 -96.65 129.33 33.25 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.688 178.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 27.3 Cg_exo -64.43 -25.61 63.34 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 123.185 2.59 . . . . 0.0 113.082 -176.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.426 ' CG2' ' HA ' ' A' ' 34' ' ' ALA . 0.9 OUTLIER -155.38 162.05 40.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.092 -178.566 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.2 m -66.15 -36.93 84.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.591 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -23.1 62.62 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -175.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -62.94 -45.14 93.88 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.88 0.371 . . . . 0.0 110.461 175.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -70.1 -41.99 73.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.509 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -59.61 -44.31 93.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.662 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.623 ' HG3' ' HA3' ' A' ' 78' ' ' GLY . 0.0 OUTLIER -69.53 -36.16 76.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.691 0.282 . . . . 0.0 110.95 -179.857 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.4 ' HB3' ' HG3' ' A' ' 62' ' ' ARG . . . -70.17 -39.06 75.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.925 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -81.53 -18.93 43.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.871 0.367 . . . . 0.0 110.733 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -59.7 -31.63 69.77 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.027 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.431 ' CE1' ' HA2' ' A' ' 78' ' ' GLY . 88.8 m-85 -95.71 132.38 40.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.772 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.93 0.85 56.25 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.443 0.64 . . . . 0.0 109.681 170.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -84.96 111.04 19.33 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 170.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.561 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 40.5 mt-10 -77.31 -10.87 59.7 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.714 -172.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -73.57 -45.01 55.89 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -66.21 -38.26 87.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.58 172.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.4 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 40.2 ttp180 -61.03 -38.41 86.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.653 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 48.9 mm-40 -60.72 -48.15 83.08 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.386 174.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.18 -49.56 76.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.835 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.519 HG12 ' HE3' ' A' ' 77' ' ' MET . 74.7 mt -64.15 -27.8 43.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.556 -176.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 66' ' ' ARG . 41.3 ttp-105 -77.11 -23.73 51.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.735 0.303 . . . . 0.0 111.259 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 23.8 mtm180 -93.71 -14.64 26.1 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -174.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.0 m -85.75 131.44 34.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.246 0.546 . . . . 0.0 111.069 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.1 t -87.97 -7.11 57.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.751 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.42 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.5 m -87.59 116.05 64.86 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.252 -177.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 16.9 Cg_exo -69.03 -51.41 0.45 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.037 2.492 . . . . 0.0 112.551 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 86.2 mtp -63.02 -38.62 91.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 111.044 -175.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 61.1 t -64.59 -39.07 84.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.486 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -51.05 55.17 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.643 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -57.91 -39.77 78.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.56 -178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -65.71 -53.72 37.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.68 0.276 . . . . 0.0 111.234 -177.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.519 ' HE3' HG12 ' A' ' 65' ' ' ILE . 27.1 ptt? -76.14 -18.96 58.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.937 0.399 . . . . 0.0 110.699 -177.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.623 ' HA3' ' HG3' ' A' ' 52' ' ' GLN . . . -83.22 -21.58 58.54 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.753 -0.737 . . . . 0.0 111.98 178.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.6 ttm105 -73.35 -9.22 58.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.149 0.5 . . . . 0.0 110.437 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.614 ' OD1' ' HG2' ' A' ' 83' ' ' LYS . 10.2 t70 -51.92 131.95 31.64 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.154 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.592 ' HD3' ' O ' ' A' ' 81' ' ' ARG . 4.5 tmt_? -112.46 -7.42 13.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.184 0.516 . . . . 0.0 110.073 -177.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.2 m -79.87 -19.02 49.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.189 0.518 . . . . 0.0 110.272 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.614 ' HG2' ' OD1' ' A' ' 80' ' ' ASP . 42.5 mmtm -75.1 161.94 75.26 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.375 176.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.532 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 32.0 Cg_endo -64.36 115.21 3.04 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.231 1.954 . . . . 0.0 111.991 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.409 HD12 ' HG2' ' A' ' 81' ' ' ARG . 96.0 mt -90.0 166.96 13.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.021 178.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -86.0 142.81 28.5 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -178.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -58.54 -48.5 80.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.397 . . . . 0.0 110.834 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -96.44 32.87 1.9 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.985 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.485 ' O ' ' HB2' ' A' ' 93' ' ' LYS . 19.2 t-105 -55.67 -44.08 76.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.028 -178.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.16 -18.94 64.0 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.007 0.432 . . . . 0.0 111.33 -177.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.0 m -90.14 -43.37 10.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.666 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.2 m -79.16 -17.25 13.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.621 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 89' ' ' TRP . 21.4 tttp -50.49 -50.16 53.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.458 0.647 . . . . 0.0 110.279 176.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -63.28 -38.23 90.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.676 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -79.74 -42.2 25.08 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.515 -173.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.7 t -61.62 -41.76 91.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.871 0.367 . . . . 0.0 110.115 177.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 49.0 tpp -62.44 -45.48 92.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.397 177.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -63.85 -38.13 89.96 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.8 178.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -61.79 -44.99 95.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.76 0.314 . . . . 0.0 110.395 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.79 -44.98 79.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.723 177.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.7 mt -59.52 -49.54 77.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.194 178.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -59.77 -48.56 81.2 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.557 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.88 -39.07 73.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.958 0.409 . . . . 0.0 110.629 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.81 -46.4 58.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.253 -175.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -82.02 -38.53 24.89 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -76.97 -33.93 57.61 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 122.086 -0.384 . . . . 0.0 111.577 -173.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -83.83 -2.8 57.12 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.141 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 65.7 m-70 -126.4 100.25 6.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.463 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.4 -32.0 66.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.89 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.446 ' HB3' HG23 ' A' ' 3' ' ' VAL . 1.4 mp0 -56.64 -50.6 71.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.089 177.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.73 -31.47 57.16 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.509 -173.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -59.15 -44.41 92.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.959 175.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.97 -46.85 89.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.655 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 56.5 tp -59.19 -47.81 83.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.848 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.429 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 48.9 tp -62.47 -50.58 70.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.479 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.513 HD12 ' HB2' ' A' ' 156' ' ' LEU . 10.6 mp -70.95 -13.33 61.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.918 -175.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.83 -22.78 60.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.762 -0.199 . . . . 0.0 111.241 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.595 ' HA ' HD13 ' A' ' 8' ' ' ILE . 47.5 p -78.72 -29.99 45.66 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.561 -177.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.449 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -51.29 136.57 30.46 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . 0.721 ' HD2' HG21 ' A' ' 11' ' ' VAL . 85.4 Cg_endo -101.39 42.57 3.19 Favored 'Cis proline' 0 CA--C 1.537 0.642 0 C-N-CA 124.757 -0.934 . . . . 0.0 113.152 -3.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.98 159.11 34.37 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 122.167 -0.333 . . . . 0.0 110.973 178.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.535 ' HB3' HG12 ' A' ' 16' ' ' ILE . 35.5 ttmt -89.49 121.09 31.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.836 0.35 . . . . 0.0 110.487 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 70.1 mt -89.67 108.82 19.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.718 -178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.615 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 96.1 t -137.91 117.31 14.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.523 -179.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 19' ' ' PHE . 44.9 tt0 -89.4 110.62 21.41 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 173.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.475 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 86.1 t60 -82.44 77.33 9.23 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 98.8 m -92.05 99.14 12.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 174.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.426 ' HG3' ' HA3' ' A' ' 137' ' ' GLY . 19.7 tt0 -79.37 -15.94 57.07 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.139 -171.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.413 ' O ' ' HB2' ' A' ' 130' ' ' ASP . 12.9 m120 -101.68 112.27 24.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.329 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 129' ' ' ASN . 23.8 m-20 72.84 110.19 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.119 0.887 . . . . 0.0 111.392 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.402 ' HB2' ' HA2' ' A' ' 141' ' ' GLY . . . -86.42 94.15 9.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.83 -179.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -159.73 111.08 2.0 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 51.5 m95 70.08 8.13 6.53 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.392 0.677 . . . . 0.0 111.322 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -125.61 -160.48 10.68 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.475 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 0.8 OUTLIER -89.89 -14.08 35.01 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 118.257 1.028 . . . . 0.0 109.768 177.425 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 69.22 17.52 72.21 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.21 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.466 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 90.11 9.33 65.69 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 121.048 -0.596 . . . . 0.0 113.514 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -160.98 -37.75 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 117.593 0.696 . . . . 0.0 112.716 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 147.78 -48.54 0.63 Allowed Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.716 -179.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -76.11 58.68 1.24 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.58 0.705 . . . . 0.0 110.403 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.402 ' HA2' ' HB2' ' A' ' 131' ' ' ALA . . . -125.51 15.23 7.18 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 174.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.472 ' C ' ' H ' ' A' ' 144' ' ' ARG . 55.4 mttm 68.99 55.92 0.42 Allowed 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.732 -0.734 . . . . 0.0 111.411 -174.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -68.91 4.9 1.29 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.544 0.688 . . . . 0.0 109.747 173.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.514 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 0.0 OUTLIER -52.89 -17.3 1.33 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.174 176.156 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 55.7 tp -58.56 -58.34 8.97 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 169.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.616 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -59.77 -30.7 69.8 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.831 175.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -67.07 -40.8 87.09 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 177.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 89.0 mt -67.87 -33.92 75.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.901 0.381 . . . . 0.0 110.228 176.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 8.2 mp -59.62 -41.65 90.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.839 172.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.616 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 53.7 mtt -61.55 -52.0 66.27 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 175.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -47.69 -54.27 12.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.332 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 56.7 tp -68.93 -39.98 79.28 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.211 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.429 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 59.8 ttp180 -58.3 -50.31 74.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.814 -177.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.608 ' HG2' ' O ' ' A' ' 150' ' ' MET . 14.7 mm-40 -59.98 -46.41 89.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.132 0.491 . . . . 0.0 110.177 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -59.53 -41.33 89.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.705 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.513 ' HB2' HD12 ' A' ' 116' ' ' LEU . 87.3 mt -77.17 -31.54 55.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.788 0.328 . . . . 0.0 110.846 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -64.27 -44.71 90.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.138 -179.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 154' ' ' GLU . 83.9 mt -57.25 -40.46 73.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.282 -179.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -80.14 -7.94 59.17 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.424 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -82.82 -26.93 31.25 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.27 -16.65 63.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.881 172.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.455 ' C ' ' H ' ' A' ' 164' ' ' HIS . 8.9 mm-40 -83.42 11.28 7.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.572 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -76.36 22.29 0.17 Allowed 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.898 0.38 . . . . 0.0 111.294 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . 0.455 ' H ' ' C ' ' A' ' 162' ' ' GLU . 65.7 t60 -72.09 97.12 1.86 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.192 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -140.45 114.17 8.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.148 174.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 70.3 t60 -141.43 -3.22 1.19 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.033 0.444 . . . . 0.0 110.649 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -122.07 132.04 54.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.598 -0.274 . . . . 0.0 110.865 178.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 7.9 p80 . . . . . 0 C--O 1.243 0.747 0 CA-C-O 118.6 -0.714 . . . . 0.0 109.82 179.551 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.729 ' H1 ' ' HD3' ' A' ' 2' ' ' PRO . 27.4 ttt . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.774 0.321 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.729 ' HD3' ' H1 ' ' A' ' 1' ' ' MET . 11.5 Cg_endo -89.75 107.02 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 123.005 2.47 . . . . 0.0 111.257 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.4 t -83.55 63.24 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-O 121.32 0.581 . . . . 0.0 110.544 -174.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.483 ' HD3' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -77.24 81.47 3.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.584 176.13 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.571 ' HA ' HD12 ' A' ' 114' ' ' LEU . . . -60.45 -56.1 25.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.56 -178.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -83.93 82.7 8.23 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.295 0.569 . . . . 0.0 110.943 -177.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.488 ' HG3' HG13 ' A' ' 8' ' ' ILE . 1.8 ptm180 -123.07 -27.02 4.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.712 178.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.488 HG13 ' HG3' ' A' ' 7' ' ' ARG . 60.5 mt -99.78 119.07 47.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 178.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.469 ' NE2' ' H ' ' A' ' 9' ' ' GLN . 0.7 OUTLIER -64.85 -59.37 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.174 0.512 . . . . 0.0 109.88 -177.741 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.435 ' C ' ' H ' ' A' ' 12' ' ' MET . 2.1 m80 -124.78 130.73 52.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.876 174.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.7 m -74.97 10.6 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.884 174.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.447 ' HB2' ' OG1' ' A' ' 15' ' ' THR . 57.3 mtm 69.09 -160.59 0.18 Allowed 'General case' 0 C--O 1.232 0.157 0 O-C-N 123.858 0.724 . . . . 0.0 109.9 -179.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -127.72 141.91 51.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -177.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 59.82 27.73 17.09 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.339 0.59 . . . . 0.0 110.713 -177.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.447 ' OG1' ' HB2' ' A' ' 12' ' ' MET . 96.8 m -92.7 124.09 36.46 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.168 -177.065 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mp -100.03 116.42 43.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.431 176.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 61.2 mt -89.86 96.73 6.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.416 0.627 . . . . 0.0 109.458 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -101.04 130.1 47.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.003 -177.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.0 p90 -132.1 177.33 7.65 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.091 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.51 103.99 5.02 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.419 177.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.1 m 63.02 -155.5 0.33 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.153 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.652 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 17.4 p -74.13 -16.0 61.02 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -177.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 m 47.67 -94.99 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 O-C-N 123.809 0.693 . . . . 0.0 111.34 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -162.46 115.27 1.69 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.581 174.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.418 ' OD1' ' HA ' ' A' ' 1' ' ' MET . 22.1 t70 68.48 -68.95 0.16 Allowed 'General case' 0 N--CA 1.47 0.565 0 O-C-N 124.069 0.855 . . . . 0.0 112.321 174.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -78.37 -1.43 33.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.528 0.68 . . . . 0.0 111.087 -175.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.652 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -74.36 -0.24 56.91 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.361 175.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -46.27 -28.45 1.29 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.05 0.94 . . . . 0.0 112.955 -176.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -53.58 -38.69 64.16 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.583 0.23 . . . . 0.0 111.584 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 10.9 t -61.82 143.89 55.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.197 0.522 . . . . 0.0 110.819 -176.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -65.26 -31.57 72.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.001 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -77.51 9.99 2.92 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.303 0.573 . . . . 0.0 110.924 -176.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.78 142.56 46.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.661 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.55 62.23 4.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.592 0.71 . . . . 0.0 111.103 -175.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.437 ' CZ2' HD22 ' A' ' 111' ' ' LEU . 86.3 m95 -105.75 102.49 38.82 Favored Pre-proline 0 C--N 1.315 -0.895 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.041 173.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -56.91 131.0 42.83 Favored 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 122.903 2.402 . . . . 0.0 112.117 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.507 HG13 ' HB2' ' A' ' 44' ' ' TRP . 18.3 pt -122.32 126.33 74.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.501 0.667 . . . . 0.0 111.248 -178.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -88.17 103.24 15.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 175.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.43 125.32 65.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.826 -174.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 62.42 23.72 14.08 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.787 0.679 . . . . 0.0 111.209 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.61 13.25 76.23 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.31 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.634 ' HD2' ' HD3' ' A' ' 66' ' ' ARG . 71.7 mmtt -117.46 154.62 31.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 m -105.19 106.28 16.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.828 0.347 . . . . 0.0 110.462 179.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.507 ' HB2' HG13 ' A' ' 37' ' ' ILE . 32.8 m95 -105.13 121.46 46.35 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -59.11 -34.5 98.73 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.735 2.29 . . . . 0.0 112.768 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.8 p -146.4 165.38 29.52 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.85 -28.99 69.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.793 0.33 . . . . 0.0 111.438 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.652 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 7.6 mp0 -64.78 -28.55 69.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.632 -178.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -64.7 -47.06 79.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.471 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -70.87 -35.72 72.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.388 0.613 . . . . 0.0 109.608 177.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -58.51 -41.77 86.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.834 177.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.652 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 68.3 mm-40 -74.37 -46.65 39.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.414 178.029 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.93 -38.63 76.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.986 -176.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -84.14 -24.5 30.21 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.542 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.681 ' HZ2' ' HB2' ' A' ' 55' ' ' LYS . 4.1 ttmp? -60.01 -42.6 94.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.154 0.502 . . . . 0.0 110.242 172.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.432 ' HD1' ' O ' ' A' ' 52' ' ' GLN . 21.8 m-85 -77.37 135.07 38.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.327 178.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.639 ' H ' HD23 ' A' ' 57' ' ' LEU . 2.4 pt? -97.63 12.79 32.39 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.339 0.59 . . . . 0.0 109.484 175.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -98.5 128.52 44.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.91 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -69.94 -35.35 74.46 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -175.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -67.76 -36.92 81.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.849 0.357 . . . . 0.0 110.33 -178.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.409 ' O ' HG13 ' A' ' 65' ' ' ILE . 6.9 m-85 -77.79 -28.18 50.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.944 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 54.6 ttp85 -59.06 -51.8 68.49 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.036 0.446 . . . . 0.0 110.208 175.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -75.57 -19.38 59.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -69.12 -46.31 67.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.211 0.529 . . . . 0.0 110.184 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.581 HG22 ' HB2' ' A' ' 52' ' ' GLN . 68.7 mt -72.95 -19.63 18.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.396 0.617 . . . . 0.0 110.12 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.634 ' HD3' ' HD2' ' A' ' 42' ' ' LYS . 12.6 ttp180 -72.72 -28.17 62.5 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.324 170.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -78.36 -41.97 31.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.253 -176.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.481 HG21 ' HB ' ' A' ' 73' ' ' VAL . 8.4 p -65.28 121.38 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.562 0.696 . . . . 0.0 111.672 -175.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.8 m -77.32 -42.28 37.36 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.422 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.4 t -70.59 127.42 91.98 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.239 -176.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -66.61 -30.69 42.25 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.799 2.333 . . . . 0.0 111.924 176.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.2 mmt -70.19 -37.88 75.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.134 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.481 ' HB ' HG21 ' A' ' 68' ' ' VAL . 47.4 t -71.99 -32.22 43.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.091 0.472 . . . . 0.0 110.078 177.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.09 -39.84 93.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.22 173.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.88 -34.72 79.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.05 175.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -61.5 -33.15 73.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.122 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 25.6 mmt -61.77 -50.84 70.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.563 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.14 -26.05 62.74 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.833 -178.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 79' ' ' ARG . 2.6 tpt180 -84.47 -0.22 52.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.932 0.396 . . . . 0.0 110.326 -178.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.02 -31.45 71.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.022 -177.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 75.6 -46.24 0.56 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.95 175.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.5 m -82.59 40.17 0.65 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.306 0.574 . . . . 0.0 111.189 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -123.24 151.67 62.65 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.139 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.35 105.17 1.68 Allowed 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.286 1.991 . . . . 0.0 112.909 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.414 HD22 ' HD3' ' A' ' 55' ' ' LYS . 54.2 mt -86.8 145.32 26.66 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 174.146 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.563 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . 8.0 ptp180 -74.17 164.53 26.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.245 0.545 . . . . 0.0 111.934 -175.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tptt -67.68 -40.75 84.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.708 -172.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.4 ' O ' HG21 ' A' ' 92' ' ' VAL . 10.3 m120 -101.34 23.48 10.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.429 -172.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.402 ' CZ2' ' HE3' ' A' ' 55' ' ' LYS . 38.7 t-105 -58.69 -47.1 85.68 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -175.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -59.35 -29.21 67.5 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -175.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.4 p -90.29 -22.6 21.5 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -176.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.4 HG21 ' O ' ' A' ' 88' ' ' ASN . 31.1 m -108.24 -5.92 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -176.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.584 ' HZ3' ' HB3' ' A' ' 93' ' ' LYS . 8.1 ttpm? -49.11 -53.64 19.75 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.095 0.474 . . . . 0.0 111.614 -178.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -71.02 -29.98 66.05 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.52 -178.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -71.35 -42.39 68.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.934 -178.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 79.6 t -60.41 -46.62 94.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.104 0.478 . . . . 0.0 110.218 176.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.426 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 52.6 ttm -64.85 -42.21 95.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.756 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -65.8 -33.5 76.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.731 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.42 -45.12 77.05 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.03 0.443 . . . . 0.0 110.154 175.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.45 98.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.607 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 97' ' ' MET . 95.0 mt -66.04 -32.59 74.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.85 177.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.502 ' HG2' HD13 ' A' ' 152' ' ' LEU . 1.9 tmm_? -64.88 -44.26 90.22 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -69.06 -32.66 72.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.031 0.443 . . . . 0.0 110.669 176.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -63.71 -47.98 78.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.106 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.412 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 56.8 m-85 -85.6 -43.3 13.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -69.36 -43.71 73.02 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.538 -174.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 27.6 mt-30 -80.1 -1.36 39.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.899 0.38 . . . . 0.0 111.44 -175.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -122.95 96.42 5.01 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 170.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -53.74 -38.19 64.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.945 -171.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -57.74 -45.8 85.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 178.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.437 HD22 ' CZ2' ' A' ' 35' ' ' TRP . 34.6 mt -68.72 -42.45 77.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.249 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.585 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 49.4 ttp85 -59.53 -45.21 92.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.551 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.57 -42.49 98.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.709 178.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.571 HD12 ' HA ' ' A' ' 5' ' ' ALA . 50.3 tp -61.71 -48.87 78.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.619 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 47.8 tp -56.93 -43.56 81.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.906 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.83 HD23 ' HG2' ' A' ' 153' ' ' ARG . 47.9 mt -68.7 -35.04 76.67 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.168 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.15 -15.1 60.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -176.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 33.7 p -82.06 -21.42 36.88 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 120.199 -0.601 . . . . 0.0 111.913 -176.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.514 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -64.01 148.18 95.5 Favored Pre-proline 0 C--O 1.234 0.247 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.492 174.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -94.5 32.67 10.68 Favored 'Cis proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.906 -1.289 . . . . 0.0 113.544 1.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.31 140.91 48.81 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 176.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -85.79 119.93 26.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.539 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 40.6 mt -80.15 122.78 27.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.499 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 80.4 t -132.48 114.67 23.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.189 0.519 . . . . 0.0 112.123 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -77.99 115.77 17.98 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 167.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.545 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 59.9 t60 -87.8 77.23 8.62 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.739 -173.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.596 ' OG1' ' HA3' ' A' ' 134' ' ' GLY . 1.0 OUTLIER -77.33 96.75 4.69 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.779 -179.588 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -93.86 -16.03 24.47 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.796 -175.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -66.97 -43.92 81.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.493 176.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -163.25 152.96 15.32 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -178.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.19 85.64 5.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.405 0.621 . . . . 0.0 110.044 178.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.49 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 37.5 t80 -149.32 106.21 3.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.566 -176.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.596 ' H ' ' HB3' ' A' ' 142' ' ' LYS . 66.9 m95 65.74 10.06 6.49 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.652 -176.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.596 ' HA3' ' OG1' ' A' ' 127' ' ' THR . . . -131.26 -161.12 10.12 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.57 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.545 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 4.0 p-10 -91.42 -6.58 52.57 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.754 0.311 . . . . 0.0 111.301 -176.009 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 76.35 7.11 84.83 Favored Glycine 0 N--CA 1.454 -0.155 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.037 177.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.434 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 82.04 40.05 10.87 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.938 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -179.35 -25.91 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.343 0.257 . . . . 0.0 111.6 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . 0.436 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 132.37 -16.31 4.9 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 119.881 -1.152 . . . . 0.0 113.776 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -133.39 82.11 1.97 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 117.315 0.558 . . . . 0.0 110.459 -177.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.39 -60.91 0.19 Allowed Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.246 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.596 ' HB3' ' H ' ' A' ' 133' ' ' TRP . 1.7 ttmp? -175.48 48.87 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -65.76 5.11 0.5 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.003 -0.998 . . . . 0.0 112.735 -171.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 30.8 ttm180 -54.84 -22.45 14.58 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 133' ' ' TRP . 66.5 tp -61.48 -59.03 5.87 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.715 0.293 . . . . 0.0 110.345 174.458 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.404 ' HA2' HD12 ' A' ' 149' ' ' LEU . . . -61.95 -31.58 79.02 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.567 176.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . 0.402 ' HB3' ' HA ' ' A' ' 144' ' ' ARG . 56.8 t80 -61.68 -43.91 97.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.529 -0.336 . . . . 0.0 110.137 176.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 94.0 mt -66.9 -36.37 82.14 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.76 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.404 HD12 ' HA2' ' A' ' 146' ' ' GLY . 97.5 mt -60.76 -44.65 96.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.554 177.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 73.2 mtm -74.26 -34.59 63.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.875 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.04 -49.63 77.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.486 0.66 . . . . 0.0 109.619 175.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.502 HD13 ' HG2' ' A' ' 102' ' ' ARG . 55.5 tp -65.5 -34.63 78.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.076 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.83 ' HG2' HD23 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -59.12 -40.09 84.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.449 -179.362 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.453 ' O ' HG13 ' A' ' 158' ' ' ILE . 13.7 mm-40 -64.71 -39.04 92.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.501 177.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -64.5 -43.67 93.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.088 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.503 ' HB2' HD22 ' A' ' 116' ' ' LEU . 89.1 mt -69.84 -31.13 68.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.888 0.375 . . . . 0.0 110.496 -177.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.88 -36.29 81.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.353 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 154' ' ' GLU . 97.4 mt -68.3 -42.72 84.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.62 178.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.71 -37.8 85.44 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.023 177.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -64.4 -35.54 81.25 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 7.2 tp -64.53 -29.52 70.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.379 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -78.92 11.15 2.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.78 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -60.7 108.04 0.78 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.511 0.672 . . . . 0.0 109.884 175.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -130.84 175.33 9.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.911 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -74.16 86.05 1.88 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.092 0.472 . . . . 0.0 110.588 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 7.4 t-80 -109.33 125.89 52.81 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -51.95 22.66 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.994 -173.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 20.9 m170 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.717 -0.659 . . . . 0.0 109.748 174.238 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.61 127.75 12.76 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.755 2.304 . . . . 0.0 112.635 -177.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 51.4 t -80.79 89.25 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -87.76 81.63 7.56 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.564 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.25 34.86 0.57 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.527 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -156.87 86.27 0.98 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.882 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.445 ' HB2' ' CZ ' ' A' ' 26' ' ' TYR . 16.0 mmt180 -114.93 -51.37 2.74 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 171.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.0 mt -106.9 104.41 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.422 177.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -99.51 -31.05 11.82 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.638 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -110.5 109.79 20.27 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.221 -178.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.1 m -85.98 159.01 3.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.979 0.419 . . . . 0.0 110.317 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.1 mtm -93.14 18.75 8.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.929 -176.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 65.78 115.8 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.311 -178.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.8 t70 52.48 66.54 1.19 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.608 0.718 . . . . 0.0 110.802 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -117.15 150.52 38.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.687 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.479 HG13 ' HD2' ' A' ' 122' ' ' LYS . 3.5 mp -98.73 107.58 20.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 120.973 0.416 . . . . 0.0 110.089 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.2 mt -90.78 111.05 23.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.946 0.403 . . . . 0.0 110.711 -178.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.465 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 0.9 OUTLIER -90.79 104.44 17.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.774 176.744 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -100.76 137.28 39.35 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.774 0.321 . . . . 0.0 110.458 -178.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.422 ' O ' ' HB3' ' A' ' 21' ' ' SER . 5.1 t80 -150.54 169.9 20.42 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.876 175.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.425 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 39.9 t 75.64 109.28 0.07 Allowed 'General case' 0 C--O 1.231 0.099 0 O-C-N 123.924 0.765 . . . . 0.0 111.721 175.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 p -81.17 2.54 27.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.388 176.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -91.57 -4.68 55.1 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.223 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -107.88 165.87 11.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.722 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -77.1 -15.11 59.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.923 -175.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.445 ' CZ ' ' HB2' ' A' ' 7' ' ' ARG . 1.4 m-85 -101.22 -1.55 33.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.916 0.389 . . . . 0.0 111.07 176.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.425 ' HA3' ' O ' ' A' ' 21' ' ' SER . . . -75.74 0.16 62.22 Favored Glycine 0 C--O 1.229 -0.214 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.906 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.489 ' CG ' ' HZ1' ' A' ' 104' ' ' LYS . 18.9 t70 -57.51 -32.95 67.54 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -63.14 -21.35 66.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.596 -177.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 75.7 m -68.05 144.26 55.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.254 0.549 . . . . 0.0 111.052 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -67.78 -20.2 65.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.86 -176.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -95.06 10.89 34.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.941 0.401 . . . . 0.0 110.9 -177.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.43 140.17 58.09 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.85 0.357 . . . . 0.0 111.286 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.501 ' HA ' HG21 ' A' ' 46' ' ' THR . . . -86.08 59.43 5.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.94 -177.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.408 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 50.3 m95 -118.9 116.09 34.55 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.729 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 28.4 Cg_exo -61.59 128.16 23.84 Favored 'Trans proline' 0 C--O 1.238 0.52 0 C-N-CA 123.098 2.532 . . . . 0.0 112.413 -178.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.51 HG21 ' HA ' ' A' ' 104' ' ' LYS . 16.4 pt -112.31 133.7 57.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.891 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -93.95 105.07 17.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.693 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.2 t -123.88 118.94 55.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.996 -175.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 58.62 27.86 16.34 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.631 0.582 . . . . 0.0 111.428 176.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.44 -7.96 66.38 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.131 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -114.67 135.68 53.89 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 122.209 -0.583 . . . . 0.0 110.802 -177.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.5 m -95.4 106.44 18.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.92 -175.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 65.6 m95 -91.38 128.83 45.41 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.795 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.44 -35.55 85.28 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.087 2.524 . . . . 0.0 113.412 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.501 HG21 ' HA ' ' A' ' 34' ' ' ALA . 65.4 p -148.84 165.25 32.06 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 9.3 m -56.83 -41.56 78.09 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.285 0.366 . . . . 0.0 110.703 177.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.771 ' O ' ' HB2' ' A' ' 52' ' ' GLN . 10.0 tp10 -73.65 -1.13 17.68 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.735 -177.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.462 ' HE2' HG12 ' A' ' 68' ' ' VAL . 18.1 m80 -85.03 -40.61 16.65 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 120.984 -1.073 . . . . 0.0 109.47 171.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -74.16 -35.97 64.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.274 0.559 . . . . 0.0 109.573 174.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.518 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 37.8 t80 -72.03 -31.29 66.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.495 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.771 ' HB2' ' O ' ' A' ' 48' ' ' GLU . 3.8 tp-100 -71.73 -45.74 60.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.297 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.92 -37.31 84.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.146 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -88.42 -8.23 55.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.348 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.701 ' HZ1' ' HB2' ' A' ' 55' ' ' LYS . 4.9 ttmp? -69.46 -30.48 68.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.329 0.585 . . . . 0.0 109.936 175.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.475 ' CE2' ' HA2' ' A' ' 78' ' ' GLY . 91.3 m-85 -116.4 175.88 5.36 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.291 -178.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.28 7.23 9.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.792 178.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.747 ' HB2' ' HB2' ' A' ' 61' ' ' TYR . 27.9 m-20 -76.0 126.45 31.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.823 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -36.52 84.26 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.49 175.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 64' ' ' GLU . 35.9 mmtm -65.18 -48.29 73.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.567 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.747 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -63.02 -45.75 90.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.154 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -54.74 -42.79 72.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.66 178.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 27.5 mt-10 -69.48 -40.64 76.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.355 178.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 6.0 mm-40 -63.77 -44.44 93.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.832 0.348 . . . . 0.0 111.319 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.658 HG21 ' HB3' ' A' ' 52' ' ' GLN . 74.7 mt -67.27 -26.13 35.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.358 0.599 . . . . 0.0 110.675 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.15 -14.99 59.7 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.92 174.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 84.8 mtp180 -96.15 -4.64 42.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.378 -178.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.462 HG12 ' HE2' ' A' ' 49' ' ' HIS . 10.0 p -110.35 132.54 58.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.047 0.451 . . . . 0.0 111.651 -174.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -93.66 -36.83 12.15 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.415 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 2.5 m -63.13 117.17 30.63 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.993 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 21.8 Cg_exo -65.36 -42.06 14.13 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.854 2.369 . . . . 0.0 112.79 -176.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.4 tpt -65.0 -36.15 83.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.098 -175.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 98.4 t -63.97 -44.01 97.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-O 120.928 0.394 . . . . 0.0 110.357 178.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.84 98.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.484 178.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.4 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -61.53 -41.64 97.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.05 178.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.64 -48.3 82.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.282 -179.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.6 ptp -71.61 -22.77 61.67 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.821 -178.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.475 ' HA2' ' CE2' ' A' ' 56' ' ' PHE . . . -77.88 -20.19 73.91 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.634 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.3 mtp85 -86.47 38.73 0.8 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.034 0.445 . . . . 0.0 111.396 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -111.05 109.6 19.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.5 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' A' ' 81' ' ' ARG . 7.2 tpt180 -90.92 0.79 57.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.499 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.9 m -66.74 -37.84 85.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.035 -176.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.435 ' HD2' ' CE1' ' A' ' 56' ' ' PHE . 9.3 ptpp? -85.26 155.04 60.36 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.796 -178.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.63 117.74 5.26 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.329 2.019 . . . . 0.0 112.123 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.12 174.88 7.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.062 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.651 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 63.1 mtp180 -71.09 143.03 50.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.611 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -47.71 -44.6 27.79 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.174 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -118.01 27.03 9.25 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.474 -175.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.651 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 29.5 t-105 -58.69 -43.4 89.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.97 -15.86 60.22 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.11 -178.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 8.0 m -98.73 -48.89 4.78 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.903 0.382 . . . . 0.0 111.191 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.436 ' O ' HG23 ' A' ' 96' ' ' VAL . 33.4 m -76.69 -8.69 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.478 -176.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.456 ' HG2' ' HZ2' ' A' ' 133' ' ' TRP . 35.9 ttmt -48.63 -53.98 16.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.743 -179.105 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -69.88 -23.42 63.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.224 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -76.27 -42.92 43.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.962 0.411 . . . . 0.0 110.24 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 92' ' ' VAL . 87.7 t -60.56 -49.84 82.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.029 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 48.6 ttm -69.4 -33.19 72.64 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.991 -178.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 98' ' ' ARG . 14.2 ttm-85 -62.39 -41.65 98.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.769 0.319 . . . . 0.0 110.167 178.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -68.09 -39.31 82.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.617 178.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.64 -46.46 89.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.571 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.405 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 96.3 mt -63.9 -39.34 93.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.721 177.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 21.5 ttt180 -58.62 -46.99 85.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.04 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.73 -33.16 73.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.884 178.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.51 ' HA ' HG21 ' A' ' 37' ' ' ILE . 61.2 tttp -56.28 -59.35 5.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.268 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.528 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 89.3 m-85 -82.49 -9.69 59.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.167 -176.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -87.95 -35.4 17.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.958 0.408 . . . . 0.0 110.721 177.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -77.17 -47.68 19.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.384 -177.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -92.88 108.44 20.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.705 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.16 -29.76 70.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.122 176.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.94 -48.2 76.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.88 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 47.9 mt -74.51 -36.62 63.21 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.433 -176.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.528 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 25.5 ttm180 -59.53 -45.09 92.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.633 176.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.82 -39.41 94.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.587 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 tp -66.17 -44.36 84.27 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.551 177.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.417 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 53.6 tp -60.39 -51.94 67.35 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.302 179.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 157' ' ' ALA . 11.0 mp -67.09 -23.09 65.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.595 -177.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -68.43 -22.6 64.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.596 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 44.9 p -71.08 -35.96 72.07 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 116.73 -0.213 . . . . 0.0 111.078 -178.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -49.31 135.86 16.44 Favored Pre-proline 0 N--CA 1.464 0.249 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.47 -179.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.5 Cg_endo -99.55 48.31 1.99 Allowed 'Cis proline' 0 CA--C 1.536 0.604 0 C-N-CA 124.184 -1.173 . . . . 0.0 113.495 0.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -88.5 160.32 17.55 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.811 0.338 . . . . 0.0 111.497 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.479 ' HD2' HG13 ' A' ' 16' ' ' ILE . 46.4 mttp -86.18 146.34 26.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.939 178.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.8 mt -108.53 112.71 25.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.144 177.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.465 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 98.6 t -128.97 124.5 61.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.875 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -86.84 117.34 25.51 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.411 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 7.1 t60 -98.24 80.1 2.63 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.427 -170.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.2 t -103.15 162.19 13.17 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 171.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -138.92 15.24 2.67 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.818 0.818 . . . . 0.0 109.81 177.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -81.77 -26.23 34.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.124 173.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -173.95 -174.15 0.9 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.607 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.44 ' HB2' ' HA3' ' A' ' 141' ' ' GLY . . . -135.32 85.6 2.18 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 175.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.517 ' C ' ' H ' ' A' ' 134' ' ' GLY . 13.1 t80 -149.13 116.45 6.11 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.456 ' HZ2' ' HG2' ' A' ' 93' ' ' LYS . 83.3 m95 74.04 -35.69 0.31 Allowed 'General case' 0 N--CA 1.477 0.919 0 O-C-N 123.908 0.755 . . . . 0.0 109.783 -169.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.517 ' H ' ' C ' ' A' ' 132' ' ' TYR . . . -117.63 -172.94 16.12 Favored Glycine 0 N--CA 1.43 -1.706 0 N-CA-C 108.184 -1.966 . . . . 0.0 108.184 177.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.634 ' HB2' ' HB2' ' A' ' 143' ' ' ASN . 0.8 OUTLIER -111.88 168.52 9.52 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 118.935 -1.106 . . . . 0.0 111.615 -175.863 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -79.18 36.24 1.96 Allowed Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.498 ' H ' ' C ' ' A' ' 135' ' ' ASP . . . 88.26 -14.75 58.5 Favored Glycine 0 CA--C 1.523 0.547 0 CA-C-N 114.935 -0.632 . . . . 0.0 114.329 177.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . 0.453 ' CE1' ' HB3' ' A' ' 140' ' ' LYS . 9.9 p80 -111.89 -53.66 2.69 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 118.202 1.001 . . . . 0.0 113.601 -171.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 130.54 53.24 0.1 OUTLIER Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.346 -0.931 . . . . 0.0 112.479 -175.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.453 ' HB3' ' CE1' ' A' ' 138' ' ' HIS . 60.8 tttp -172.92 37.43 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.208 0.528 . . . . 0.0 110.155 -178.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.44 ' HA3' ' HB2' ' A' ' 131' ' ' ALA . . . -123.42 -65.28 0.21 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 120.095 -1.05 . . . . 0.0 113.217 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.534 ' C ' ' H ' ' A' ' 144' ' ' ARG . 48.4 tttp -173.2 25.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 117.255 0.527 . . . . 0.0 112.211 175.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.634 ' HB2' ' HB2' ' A' ' 135' ' ' ASP . 9.9 t30 -51.54 5.65 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.19 1.396 . . . . 0.0 114.166 173.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.534 ' H ' ' C ' ' A' ' 142' ' ' LYS . 9.9 tpt180 -45.57 -21.02 0.08 Allowed 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 22.9 tp -57.58 -45.76 84.83 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.891 0.377 . . . . 0.0 110.496 174.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -62.64 -31.46 80.04 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.701 -0.559 . . . . 0.0 111.701 178.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -66.8 -39.76 87.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 175.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 70.1 mt -63.61 -42.56 98.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.953 176.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 98.8 mt -60.71 -45.52 93.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.831 178.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.547 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 71.5 mtm -67.25 -39.05 86.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.96 178.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -61.86 -45.38 94.01 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.126 0.489 . . . . 0.0 110.306 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 67.6 tp -64.58 -39.11 93.15 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.658 177.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.417 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 59.8 ttp180 -56.59 -49.8 73.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.314 177.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 150' ' ' MET . 14.1 mm-40 -62.13 -36.27 81.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.603 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -62.23 -56.13 21.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.313 176.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.487 HD23 ' NH2' ' A' ' 112' ' ' ARG . 37.3 mt -68.89 -25.14 64.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.098 -173.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.508 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -62.68 -52.39 63.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.107 173.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 73.0 mt -73.0 -38.26 55.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.794 -179.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -57.33 -47.39 81.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.477 177.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.411 ' HB3' ' HZ3' ' A' ' 160' ' ' LYS . 3.7 ttpm? -79.61 -14.4 58.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.101 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 18.5 tp -76.76 -20.52 56.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.169 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -67.06 -0.04 2.94 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.869 177.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.545 ' HD1' ' N ' ' A' ' 164' ' ' HIS . 0.0 OUTLIER -62.04 -16.33 51.08 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-O 121.009 0.433 . . . . 0.0 110.2 171.207 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . 0.545 ' N ' ' HD1' ' A' ' 163' ' ' HIS . 11.4 t-160 -88.32 75.46 8.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 175.075 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -71.81 126.08 28.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.322 -170.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 67.25 -87.52 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.801 175.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 173.44 -52.14 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -177.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 75.8 t60 . . . . . 0 C--O 1.248 1.0 0 CA-C-N 114.44 -1.254 . . . . 0.0 108.325 170.88 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.479 0.976 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.489 ' O ' ' HB ' ' A' ' 3' ' ' VAL . 26.6 Cg_exo -61.99 87.29 0.1 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.905 2.403 . . . . 0.0 112.03 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.489 ' HB ' ' O ' ' A' ' 2' ' ' PRO . 14.9 p 165.97 -30.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.364 -176.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.54 ' HB3' HE22 ' A' ' 6' ' ' GLN . 39.9 mtm105 62.41 83.53 0.15 Allowed 'General case' 0 C--N 1.342 0.254 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.141 -176.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.27 76.46 8.39 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.37 -176.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.54 HE22 ' HB3' ' A' ' 4' ' ' ARG . 2.3 mp0 -89.43 133.67 34.43 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.752 175.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.5 mtp85 -103.09 125.78 49.97 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.924 0.392 . . . . 0.0 111.983 -176.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 75.5 mt -74.38 122.37 27.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 166.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -69.41 86.74 0.44 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.823 0.344 . . . . 0.0 110.781 -176.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 67.95 136.22 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.72 -178.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 m -84.75 16.18 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.991 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 43.3 mtm 66.77 -100.43 0.06 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.746 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 179.37 148.21 0.24 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 62.51 10.38 3.99 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 123.421 0.45 . . . . 0.0 111.603 177.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.1 m -83.35 114.36 21.37 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.302 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 51.6 mt -96.68 114.08 32.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.777 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.7 mt -93.21 109.97 22.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.433 -175.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.478 ' N ' HD21 ' A' ' 18' ' ' ASN . 0.9 OUTLIER -96.41 103.56 15.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.763 177.138 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -109.15 127.11 53.92 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.234 -176.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -150.55 100.59 2.87 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.66 170.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 m 161.89 101.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.209 1.404 . . . . 0.0 108.291 -177.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.506 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 10.2 p -79.46 -55.4 5.08 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.646 0.26 . . . . 0.0 111.376 -176.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m 56.65 -95.35 0.05 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.676 -176.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -178.2 21.03 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.094 0.473 . . . . 0.0 110.576 178.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.417 ' CG ' ' H ' ' A' ' 26' ' ' TYR . 14.9 p30 -136.97 -90.95 0.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -177.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.417 ' H ' ' CG ' ' A' ' 25' ' ' ASP . 28.5 t80 -86.41 -4.95 59.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.57 0.7 . . . . 0.0 110.182 -173.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.506 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -73.31 -0.02 50.65 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.223 -0.898 . . . . 0.0 112.945 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.533 ' CG ' ' HZ3' ' A' ' 104' ' ' LYS . 34.5 t70 -54.54 -23.57 17.16 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -176.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -64.88 -29.11 70.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.599 178.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.1 t -77.6 143.47 38.26 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -62.04 -30.91 71.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.934 0.397 . . . . 0.0 110.824 -174.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.487 ' HB3' HG22 ' A' ' 22' ' ' THR . 16.7 t80 -75.47 11.53 1.24 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.416 -173.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.442 ' CB ' ' HA ' ' A' ' 28' ' ' ASP . . . -73.83 106.0 5.36 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 175.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.547 ' HA ' ' HB ' ' A' ' 46' ' ' THR . . . -74.32 59.93 0.81 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.624 0.726 . . . . 0.0 112.522 -171.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 62.0 m95 -93.67 125.54 53.17 Favored Pre-proline 0 C--N 1.312 -1.06 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.742 172.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.55 125.37 17.17 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 122.678 2.252 . . . . 0.0 112.042 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.646 HG21 ' HA ' ' A' ' 104' ' ' LYS . 15.3 pt -114.99 141.87 30.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.872 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -100.05 100.1 10.93 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.415 HG13 ' OD2' ' A' ' 40' ' ' ASP . 4.5 t -124.04 127.08 73.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.11 -174.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.415 ' OD2' HG13 ' A' ' 39' ' ' VAL . 24.6 m-20 63.5 6.7 2.64 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.965 0.791 . . . . 0.0 111.913 176.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 114.02 -3.13 24.14 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.556 -0.83 . . . . 0.0 113.088 177.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -123.15 155.28 37.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.247 0.523 . . . . 0.0 111.065 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.6 m -94.73 119.98 34.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.448 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.479 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 37.9 m95 -109.13 124.21 34.69 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.445 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.566 ' O ' ' HB ' ' A' ' 46' ' ' THR . 4.8 Cg_exo -76.05 48.05 2.16 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.32 2.68 . . . . 0.0 113.683 -175.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.566 ' HB ' ' O ' ' A' ' 45' ' ' PRO . 1.6 t 129.57 160.69 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.5 1.52 . . . . 0.0 109.701 172.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 m -58.77 -38.78 79.25 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 123.563 0.539 . . . . 0.0 111.294 -177.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -53.11 -43.1 66.61 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.305 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 32.2 m80 -64.53 -39.52 93.92 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.328 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -76.1 -46.5 28.61 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.582 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -60.03 -50.03 75.34 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.578 -178.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.733 HE21 ' HA3' ' A' ' 78' ' ' GLY . 42.0 tp60 -64.63 -39.89 94.5 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.662 -177.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.838 ' HB2' ' HG3' ' A' ' 62' ' ' ARG . . . -68.71 -35.45 77.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.598 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -79.62 -16.84 55.1 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.909 0.385 . . . . 0.0 110.333 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.447 ' HE3' ' CD1' ' A' ' 89' ' ' TRP . 79.8 tttt -67.41 -21.8 65.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.793 -178.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.425 ' HZ ' ' CA ' ' A' ' 78' ' ' GLY . 82.2 m-85 -102.21 178.47 4.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.079 0.466 . . . . 0.0 111.901 -175.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.415 ' N ' HD13 ' A' ' 57' ' ' LEU . 5.6 mp -111.17 -37.01 5.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.642 -175.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.516 ' OD2' ' HB2' ' A' ' 61' ' ' TYR . 1.8 p-10 -75.5 111.65 11.02 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.602 0.715 . . . . 0.0 110.582 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -62.06 -32.85 73.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.658 -1.156 . . . . 0.0 111.791 -174.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.42 -37.9 76.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.105 0.479 . . . . 0.0 109.915 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.516 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . 2.0 t80 -77.06 -33.85 57.16 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.073 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.838 ' HG3' ' HB2' ' A' ' 53' ' ' ALA . 32.2 ttp85 -57.73 -44.84 86.3 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.372 0.606 . . . . 0.0 109.803 174.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -68.44 -31.57 70.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.233 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -70.14 -33.22 71.53 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.358 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.49 HD12 ' HA ' ' A' ' 53' ' ' ALA . 75.2 mt -72.65 -23.19 20.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.005 0.431 . . . . 0.0 110.772 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.454 ' HB2' ' CZ3' ' A' ' 44' ' ' TRP . 55.3 ttp85 -84.33 -20.67 31.66 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.286 0.565 . . . . 0.0 109.637 171.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -75.99 -30.55 58.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.143 -177.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.9 p -78.47 129.31 37.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.92 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 43.9 t -77.19 -37.58 53.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.583 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.431 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.9 m -77.18 119.55 77.95 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 -177.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 22.1 Cg_exo -65.2 -37.59 31.24 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.844 2.363 . . . . 0.0 112.401 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.4 tpt -65.35 -41.15 94.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.819 -176.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 94.5 t -60.22 -38.05 75.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.129 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.458 ' HB2' HG22 ' A' ' 65' ' ' ILE . . . -60.81 -58.51 8.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.015 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' ' 79' ' ' ARG . . . -60.98 -37.84 83.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.937 178.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.84 -49.92 73.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.73 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.456 ' HE1' ' HA ' ' A' ' 74' ' ' ALA . 27.1 ptt? -78.42 -19.28 53.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.867 0.365 . . . . 0.0 110.967 -176.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.733 ' HA3' HE21 ' A' ' 52' ' ' GLN . . . -93.85 0.03 66.82 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.41 176.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 33.1 ttt180 -89.95 -9.93 46.98 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -79.03 164.38 24.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.573 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -94.21 -5.99 45.71 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.275 -174.104 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.7 m -72.33 -8.04 52.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.171 0.51 . . . . 0.0 111.299 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -111.71 123.44 34.74 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.033 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.8 119.9 6.86 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.422 2.081 . . . . 0.0 111.185 173.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 59.2 mt -88.87 156.5 18.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.05 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.634 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 67.1 mtt180 -61.85 125.96 25.68 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 176.129 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -54.11 -44.13 71.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.933 -174.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -102.07 27.29 6.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.378 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.634 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 73.7 t-105 -58.15 -44.12 87.7 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.235 179.037 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -61.36 -21.95 64.5 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.591 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.9 m -80.55 -38.05 30.31 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.783 0.325 . . . . 0.0 110.874 177.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.4 m -97.32 1.91 10.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.087 0.47 . . . . 0.0 111.228 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -55.64 29.49 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.964 -178.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.82 -28.9 70.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.362 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -70.01 -51.35 32.99 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.795 0.331 . . . . 0.0 110.522 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 87.3 t -62.72 -39.3 84.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.4 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.792 ' HA ' ' HE3' ' A' ' 97' ' ' MET . 3.3 tpt -63.4 -43.21 98.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.203 178.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.629 ' HA ' HD13 ' A' ' 148' ' ' LEU . 56.7 ttp180 -61.8 -40.48 95.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.772 179.371 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -65.33 -50.53 65.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.765 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.82 -45.87 87.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.406 -177.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.748 ' HG ' ' HE1' ' A' ' 97' ' ' MET . 35.0 mt -65.17 -37.66 88.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.994 -176.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.636 ' HG3' HD21 ' A' ' 156' ' ' LEU . 31.2 ttp85 -67.67 -36.58 80.98 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.365 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.579 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -66.2 -31.77 72.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.117 0.484 . . . . 0.0 109.989 177.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.646 ' HA ' HG21 ' A' ' 37' ' ' ILE . 59.7 tttm -62.77 -49.35 75.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.886 179.115 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.469 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 81.8 m-85 -82.32 -33.32 29.0 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -176.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -75.26 -19.25 59.82 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 121.944 -0.472 . . . . 0.0 111.567 -179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.579 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.0 OUTLIER -86.38 -46.39 10.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.77 0.319 . . . . 0.0 110.242 177.329 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -99.39 100.22 11.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.463 ' HB2' HH21 ' A' ' 112' ' ' ARG . . . -62.29 -31.83 72.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.399 -173.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.409 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.6 pm0 -68.87 -33.87 74.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.666 0.27 . . . . 0.0 110.661 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 57.9 mt -73.19 -35.99 66.48 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 176.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.469 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 28.0 ttp85 -58.17 -48.67 79.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.478 175.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.58 -40.03 93.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.593 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.6 tp -61.5 -43.45 98.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.633 178.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 39.5 tp -62.04 -56.42 19.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.629 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.3 mp -66.88 -16.55 64.38 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.991 -0.284 . . . . 0.0 111.5 -176.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -75.96 -13.2 60.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 60.7 p -89.23 -16.44 31.24 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 120.39 -0.524 . . . . 0.0 111.441 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.508 ' HB3' ' HD2' ' A' ' 153' ' ' ARG . . . -55.7 139.41 68.92 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.722 176.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -101.26 39.14 4.8 Favored 'Cis proline' 0 CA--C 1.535 0.548 0 C-N-CA 124.295 -1.127 . . . . 0.0 113.492 -1.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.04 153.56 42.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 0.0 111.151 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.512 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 56.3 tttp -86.98 122.98 31.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.035 -178.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 42.9 mt -91.2 125.13 35.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.527 -177.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 87.9 t -138.54 138.09 42.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.241 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -107.26 141.98 37.74 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -105.25 77.58 1.31 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.52 0.676 . . . . 0.0 109.612 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.69 86.36 5.3 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.731 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -78.02 -23.72 48.12 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.001 -174.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -83.69 -22.36 32.08 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -175.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -154.69 148.34 25.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.866 0.365 . . . . 0.0 110.824 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.517 ' HB2' ' HA2' ' A' ' 141' ' ' GLY . . . -106.56 87.43 2.53 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.621 -177.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.502 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 3.7 t80 -147.55 -37.75 0.2 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.852 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.558 ' HB3' HD23 ' A' ' 145' ' ' LEU . 7.1 m95 -134.45 32.55 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -176.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -162.21 -128.35 0.94 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 119.66 -1.257 . . . . 0.0 112.374 -177.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.31 -7.98 16.52 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.335 0.588 . . . . 0.0 109.688 174.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 70.69 6.06 58.16 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.539 178.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 83.58 11.4 80.0 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.303 -0.475 . . . . 0.0 112.467 -176.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -164.06 28.22 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.689 0.244 . . . . 0.0 111.14 -177.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 81.18 -51.31 4.34 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.558 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -80.7 58.32 3.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.174 0.511 . . . . 0.0 110.823 -175.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.517 ' HA2' ' HB2' ' A' ' 131' ' ' ALA . . . -123.3 15.26 8.18 Favored Glycine 0 C--N 1.318 -0.461 0 CA-C-N 115.754 -0.657 . . . . 0.0 113.85 -178.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.502 ' HD2' ' HA ' ' A' ' 132' ' ' TYR . 50.3 mttm 69.12 78.47 0.21 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.253 0.549 . . . . 0.0 111.375 178.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -70.06 5.31 1.67 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.335 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.427 ' H ' ' C ' ' A' ' 142' ' ' LYS . 0.0 OUTLIER -59.16 -18.62 37.76 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -177.247 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.558 HD23 ' HB3' ' A' ' 133' ' ' TRP . 43.1 tp -65.79 -53.0 46.12 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 118.239 0.472 . . . . 0.0 109.993 175.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -58.92 -39.56 94.22 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 177.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -64.69 -44.87 88.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.714 -0.243 . . . . 0.0 110.659 177.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.629 HD13 ' HA ' ' A' ' 98' ' ' ARG . 1.7 tm? -60.44 -45.94 91.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 90.5 mt -56.37 -43.46 79.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.157 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.512 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 73.8 mtm -72.46 -43.47 63.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.13 -179.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -66.73 -39.5 87.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.988 0.423 . . . . 0.0 110.457 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' A' ' 102' ' ' ARG . 55.0 tp -66.47 -37.65 85.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.849 176.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.63 HH11 ' HG2' ' A' ' 153' ' ' ARG . 23.3 ttp85 -61.23 -36.11 79.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.397 176.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 150' ' ' MET . 49.7 mm-40 -58.64 -49.18 78.45 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.035 0.445 . . . . 0.0 110.229 174.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -62.68 -46.01 90.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.831 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.636 HD21 ' HG3' ' A' ' 102' ' ' ARG . 97.8 mt -64.22 -32.96 74.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.752 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.35 -61.32 1.84 Allowed 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.09 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 69.6 mt -58.0 -38.47 67.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -170.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -64.23 -33.36 75.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.024 0.44 . . . . 0.0 111.228 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -94.03 -20.16 20.2 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.574 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 26.0 tp -72.63 -32.95 66.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.68 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.506 ' OE2' ' HB2' ' A' ' 164' ' ' HIS . 9.2 tm-20 -49.14 -52.68 24.75 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.554 173.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 70.7 -16.51 0.33 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.866 167.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . 0.506 ' HB2' ' OE2' ' A' ' 162' ' ' GLU . 86.9 m-70 -73.53 -21.22 60.45 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -57.6 103.51 0.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.107 173.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -117.2 121.14 40.4 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.942 -177.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -141.12 19.25 2.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.417 0.627 . . . . 0.0 109.625 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 . . . . . 0 C--O 1.244 0.811 0 CA-C-O 118.446 -0.788 . . . . 0.0 109.701 177.51 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 mmt . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 120.453 0.168 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -61.37 -38.64 62.98 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.542 2.161 . . . . 0.0 111.41 174.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.662 HG21 ' HB2' ' A' ' 25' ' ' ASP . 3.4 p -96.81 127.75 48.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 172.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 55.1 mtt85 -119.87 -36.85 3.2 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.114 -0.235 . . . . 0.0 111.235 -172.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.486 ' HB2' HD13 ' A' ' 114' ' ' LEU . . . 65.63 14.49 9.54 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.811 0.694 . . . . 0.0 110.472 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -100.96 17.2 22.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.833 -175.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.651 ' HB3' ' CD2' ' A' ' 26' ' ' TYR . 79.2 ttt180 -66.11 -35.36 80.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.286 0.565 . . . . 0.0 109.556 175.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.427 ' HB ' ' OH ' ' A' ' 26' ' ' TYR . 67.1 mt -133.56 -65.74 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.294 174.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 73.56 -63.11 0.44 Allowed 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.917 0.76 . . . . 0.0 110.84 176.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -102.34 116.7 33.18 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 176.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.4 m -87.52 -175.14 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.113 -177.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.489 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 10.1 mtt -97.7 -85.41 0.36 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.587 -174.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.489 ' H ' ' HB2' ' A' ' 12' ' ' MET . 3.2 pt20 -177.97 114.68 0.08 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.873 179.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.9 t70 57.9 31.53 20.7 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.812 0.815 . . . . 0.0 110.289 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.5 m -76.33 146.4 38.85 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.766 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.2 mt -109.01 108.69 25.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.222 0.534 . . . . 0.0 110.516 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.4 mt -89.91 101.81 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.158 -175.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -97.45 101.15 12.62 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.123 172.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -101.19 154.06 19.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.823 -176.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -150.17 164.32 35.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.1 p 54.09 100.61 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.632 0.773 . . . . 0.0 111.843 -177.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -69.02 2.99 2.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.62 -175.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.0 p -56.41 -36.72 69.25 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -176.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -92.69 165.52 12.92 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.287 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.662 ' HB2' HG21 ' A' ' 3' ' ' VAL . 6.0 p-10 -82.57 2.17 34.45 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -171.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.651 ' CD2' ' HB3' ' A' ' 7' ' ' ARG . 0.9 OUTLIER -101.16 -4.4 27.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.187 0.518 . . . . 0.0 109.851 174.941 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -93.34 -0.23 67.77 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.682 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.451 ' CG ' HD21 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -58.0 -21.67 45.97 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -173.044 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.463 ' CZ ' ' HG ' ' A' ' 114' ' ' LEU . 97.1 m-85 -55.33 -21.73 16.25 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -177.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.513 ' HA ' ' OE2' ' A' ' 125' ' ' GLU . 22.8 t -62.42 141.68 58.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.097 0.475 . . . . 0.0 110.477 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -73.34 -21.38 60.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.751 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -90.81 6.08 45.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.176 0.512 . . . . 0.0 110.29 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.15 137.22 57.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.02 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.445 ' HA ' HG21 ' A' ' 46' ' ' THR . . . -84.7 59.69 5.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.294 0.568 . . . . 0.0 111.136 -176.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.55 ' HB2' ' HE2' ' A' ' 104' ' ' LYS . 81.4 m95 -112.18 113.36 51.75 Favored Pre-proline 0 C--N 1.318 -0.796 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.882 176.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.58 125.65 19.73 Favored 'Trans proline' 0 C--O 1.237 0.475 0 C-N-CA 123.289 2.659 . . . . 0.0 112.785 -176.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.651 HG23 ' HA ' ' A' ' 104' ' ' LYS . 26.9 pt -115.95 146.44 20.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.681 179.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -109.72 103.32 12.13 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.4 t -122.77 124.06 69.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.705 -175.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 59.62 24.93 13.77 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 123.805 0.691 . . . . 0.0 111.085 178.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.27 -4.02 82.46 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.881 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -104.44 138.56 40.65 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 122.363 -0.492 . . . . 0.0 110.805 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.9 m -90.74 114.31 26.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.454 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.448 ' HB2' HG13 ' A' ' 37' ' ' ILE . 51.3 m95 -108.58 130.62 22.53 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.82 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -65.95 -28.83 49.82 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.614 2.209 . . . . 0.0 112.467 -178.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.445 HG21 ' HA ' ' A' ' 34' ' ' ALA . 19.6 p -147.7 162.71 38.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.983 -177.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.1 m -66.85 -30.25 70.37 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.037 0.446 . . . . 0.0 110.616 178.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.411 ' OE1' ' HB3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -64.11 -28.99 70.15 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.611 -177.048 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.618 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 28.2 m80 -66.87 -41.81 86.68 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.971 -0.292 . . . . 0.0 110.845 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -70.9 -37.97 73.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.394 0.616 . . . . 0.0 109.511 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.467 ' HA ' HG11 ' A' ' 96' ' ' VAL . 78.3 t80 -61.35 -40.14 93.17 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.489 176.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.519 ' NE2' ' HA ' ' A' ' 75' ' ' ALA . 4.3 tp60 -72.28 -45.32 60.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.652 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.892 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -65.69 -38.91 90.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.168 -177.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.37 -16.94 44.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.582 0.215 . . . . 0.0 111.582 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.854 ' HZ3' ' HB2' ' A' ' 55' ' ' LYS . 4.8 ttmp? -57.2 -38.39 73.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.156 0.503 . . . . 0.0 110.526 173.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -98.93 149.08 23.32 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.337 -178.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.734 ' H ' HD22 ' A' ' 57' ' ' LEU . 2.3 pt? -95.71 1.95 53.71 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.244 0.545 . . . . 0.0 110.065 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -87.79 111.08 20.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.137 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.422 ' OE2' ' HD2' ' A' ' 62' ' ' ARG . 6.9 tp10 -60.43 -33.47 72.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.958 -177.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -62.71 -51.83 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.879 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.436 ' O ' ' HB3' ' A' ' 64' ' ' GLU . 0.5 OUTLIER -66.93 -29.8 69.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.018 0.437 . . . . 0.0 110.418 179.724 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.892 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.4 ttm180 -65.28 -41.32 94.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.122 175.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -62.96 -35.89 81.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.717 175.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.436 ' HB3' ' O ' ' A' ' 61' ' ' TYR . 11.4 tp10 -60.9 -55.43 33.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.905 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.536 ' O ' HG11 ' A' ' 68' ' ' VAL . 1.8 mp -61.98 -25.95 38.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 120.901 0.382 . . . . 0.0 111.309 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -71.87 -35.78 69.89 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 121.784 -0.572 . . . . 0.0 111.353 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -86.37 -0.03 55.04 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.702 -173.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.536 HG11 ' O ' ' A' ' 65' ' ' ILE . 11.9 p -95.59 117.54 39.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.32 0.581 . . . . 0.0 110.02 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.8 m -81.95 -24.97 35.25 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.991 0.424 . . . . 0.0 110.455 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.4 m -77.22 116.45 57.63 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.307 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.618 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 31.5 Cg_exo -59.85 -55.02 1.88 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.192 2.595 . . . . 0.0 113.064 -175.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 18.2 ttt -65.58 -22.84 66.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.498 -172.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 95.7 t -72.59 -37.79 57.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.838 0.351 . . . . 0.0 110.259 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.68 -45.81 92.74 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.051 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.519 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -62.2 -42.58 99.42 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.532 176.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -60.06 -55.91 28.08 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.579 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -74.78 -19.29 60.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.836 0.351 . . . . 0.0 111.121 -177.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.4 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -93.82 0.18 67.04 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.81 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 46.5 ttt180 -79.47 -0.61 33.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.196 0.522 . . . . 0.0 109.831 175.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -75.96 127.79 33.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.912 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.7 ttt180 -98.29 7.8 45.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.693 -175.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.2 m -83.01 -15.45 51.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.23 0.538 . . . . 0.0 110.344 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -79.32 150.24 73.63 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.147 179.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.412 ' HB2' HD21 ' A' ' 57' ' ' LEU . 18.3 Cg_endo -58.23 110.41 0.64 Allowed 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.657 2.238 . . . . 0.0 112.333 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.2 mt -85.99 120.77 27.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.829 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -68.63 134.0 49.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.257 0.551 . . . . 0.0 110.292 -178.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.51 -28.46 64.97 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.447 -170.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -90.88 16.88 8.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.561 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.475 ' CZ3' ' HA ' ' A' ' 55' ' ' LYS . 53.7 t-105 -58.98 -33.37 70.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.301 0.572 . . . . 0.0 109.871 174.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -56.63 -42.13 78.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.255 175.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 m -81.01 -43.34 19.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.69 -175.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.438 HG22 ' HA ' ' A' ' 89' ' ' TRP . 29.6 m -87.45 -3.46 9.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -170.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.477 ' HG3' ' N ' ' A' ' 94' ' ' GLU . 6.3 ptpp? -57.36 -36.88 71.78 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.839 0.352 . . . . 0.0 110.764 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.477 ' N ' ' HG3' ' A' ' 93' ' ' LYS . 7.6 pt-20 -78.41 -33.53 48.65 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.135 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -63.1 -43.77 97.57 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 -178.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.467 HG11 ' HA ' ' A' ' 51' ' ' PHE . 54.4 t -64.16 -49.17 82.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.382 176.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 10.1 mmt -61.45 -54.13 47.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.865 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -64.34 -27.09 68.79 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.789 -0.187 . . . . 0.0 111.314 -175.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -77.41 -46.38 22.85 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 176.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.64 -42.06 98.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.738 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.431 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 91.5 mt -64.88 -37.42 87.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.705 178.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.48 ' HA ' HD21 ' A' ' 152' ' ' LEU . 21.5 ttm-85 -63.46 -45.03 92.7 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 177.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.505 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -63.49 -38.37 90.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.781 0.324 . . . . 0.0 110.311 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.651 ' HA ' HG23 ' A' ' 37' ' ' ILE . 15.0 tptp -54.11 -56.3 19.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.499 176.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -80.64 -46.48 15.56 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -175.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.516 ' OE2' HD22 ' A' ' 156' ' ' LEU . 18.2 mm-40 -65.61 -21.56 66.59 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -175.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.505 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.8 tp-100 -79.29 -44.48 21.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.096 0.474 . . . . 0.0 110.506 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.421 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 64.5 m-70 -99.54 112.23 24.47 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.924 -176.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -59.39 -32.16 69.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.844 0.354 . . . . 0.0 110.352 178.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -58.01 -60.1 4.24 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.034 177.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.451 HD21 ' CG ' ' A' ' 28' ' ' ASP . 13.0 mt -69.44 -34.47 74.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.497 -175.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 108' ' ' HIS . 18.8 ttt180 -54.86 -54.67 39.41 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.137 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.13 -36.73 80.16 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.565 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' A' ' 5' ' ' ALA . 42.9 tp -58.09 -48.5 79.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.803 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.438 HD22 HD12 ' A' ' 156' ' ' LEU . 49.2 tp -58.61 -48.78 79.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.26 178.239 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.484 HD21 ' HB2' ' A' ' 156' ' ' LEU . 33.5 mt -70.16 -18.4 63.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.764 0.316 . . . . 0.0 111.339 -175.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -80.74 -14.82 57.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.682 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 72.9 p -73.74 -31.62 63.45 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.297 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -57.71 136.37 82.82 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.993 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -100.44 72.13 0.16 OUTLIER 'Cis proline' 0 N--CA 1.455 -0.768 0 C-N-CA 124.267 -1.139 . . . . 0.0 113.529 -0.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -110.98 157.59 19.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.842 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.434 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 0.3 OUTLIER -83.58 140.96 31.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.172 176.04 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.469 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 67.7 mt -109.02 114.83 28.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.304 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 42.3 t -129.09 115.9 38.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.153 -177.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.513 ' OE2' ' HA ' ' A' ' 30' ' ' SER . 40.2 tt0 -80.73 133.63 35.7 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 172.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 45.1 t60 -121.75 119.47 31.8 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.194 -175.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 13.0 t -121.9 166.45 14.39 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 170.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.465 ' HA ' ' HA3' ' A' ' 137' ' ' GLY . 3.9 mp0 -116.34 4.93 13.48 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.946 173.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -124.63 110.97 15.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.524 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 25.7 t70 74.47 112.75 0.07 Allowed 'General case' 0 N--CA 1.465 0.291 0 O-C-N 124.563 1.164 . . . . 0.0 111.867 176.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.52 ' HB2' ' HA2' ' A' ' 141' ' ' GLY . . . -86.39 112.79 21.79 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.964 178.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -155.21 -68.49 0.12 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.452 -176.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.551 ' HB3' HD23 ' A' ' 145' ' ' LEU . 92.1 m95 -110.34 58.18 0.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.414 0.626 . . . . 0.0 109.504 177.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 131.31 156.73 8.57 Favored Glycine 0 N--CA 1.442 -0.95 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 -171.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.968 ' HA ' ' HA3' ' A' ' 141' ' ' GLY . 14.2 t0 -54.75 137.34 44.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.769 0.284 . . . . 0.0 111.715 -174.032 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.421 ' HA3' ' HB1' ' A' ' 131' ' ' ALA . . . -88.01 31.18 4.79 Favored Glycine 0 C--N 1.333 0.367 0 O-C-N 123.58 0.55 . . . . 0.0 111.988 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.465 ' HA3' ' HA ' ' A' ' 128' ' ' GLU . . . 78.98 54.48 4.12 Favored Glycine 0 C--N 1.317 -0.486 0 CA-C-N 114.838 -0.681 . . . . 0.0 114.076 177.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . 0.478 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 4.7 p80 -174.79 -37.11 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 135.09 25.36 0.54 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 120.194 -1.003 . . . . 0.0 112.654 -175.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.478 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 96.9 mttt -156.68 91.01 1.19 Allowed 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.968 ' HA3' ' HA ' ' A' ' 135' ' ' ASP . . . -142.16 1.18 1.65 Allowed Glycine 0 C--N 1.312 -0.776 0 C-N-CA 119.614 -1.279 . . . . 0.0 114.604 -178.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.444 ' C ' ' H ' ' A' ' 144' ' ' ARG . 24.5 mtmm 65.29 88.96 0.1 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.634 0.73 . . . . 0.0 110.37 -176.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -67.56 5.21 0.84 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.378 178.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.592 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 5.9 mmt180 -54.09 -24.74 18.62 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.551 HD23 ' HB3' ' A' ' 133' ' ' TRP . 52.1 tp -65.89 -52.96 45.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.106 0.479 . . . . 0.0 109.893 175.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.469 ' HA3' ' O ' ' A' ' 123' ' ' LEU . . . -66.21 -28.3 73.59 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.658 176.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -64.71 -37.74 88.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 91.9 mt -69.8 -35.91 75.23 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.374 175.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.456 HD13 ' HA2' ' A' ' 146' ' ' GLY . 95.7 mt -61.59 -44.68 96.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.185 176.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.543 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 74.3 mtm -72.74 -30.95 64.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.782 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -62.32 -54.2 44.04 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.48 HD21 ' HA ' ' A' ' 102' ' ' ARG . 56.6 tp -61.25 -39.3 89.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.847 178.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -53.0 -55.32 24.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.045 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 150' ' ' MET . 11.4 mm-40 -62.36 -39.19 92.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.222 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.762 HE21 ' HA ' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -61.18 -45.66 93.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.507 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.679 ' O ' ' HG2' ' A' ' 160' ' ' LYS . 87.2 mt -64.55 -44.78 89.68 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.458 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.18 -51.47 68.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.165 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 154' ' ' GLU . 82.1 mt -55.78 -40.98 64.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 O-C-N 123.072 0.232 . . . . 0.0 110.632 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.2 -47.9 84.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.686 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.679 ' HG2' ' O ' ' A' ' 156' ' ' LEU . 46.6 mmtm -67.13 -35.23 79.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.739 -177.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.48 -23.23 65.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.513 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -81.61 4.85 20.05 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -175.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -72.47 87.8 1.2 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 122.232 1.015 . . . . 0.0 110.924 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -125.08 139.39 53.83 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.205 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -93.25 82.06 4.5 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.999 0.428 . . . . 0.0 110.664 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -119.85 26.28 9.42 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -78.2 73.2 4.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.589 0.709 . . . . 0.0 110.205 -178.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 78.6 t60 . . . . . 0 C--O 1.248 1.009 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.938 177.263 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.9 ttp . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.62 102.73 0.36 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.508 2.139 . . . . 0.0 111.866 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.54 125.4 28.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.085 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 72.9 mtm180 -115.66 11.36 15.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.556 -176.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.22 -25.29 65.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.45 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -81.61 35.52 0.41 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.582 -177.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -71.42 -45.53 62.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.815 0.341 . . . . 0.0 110.605 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.7 mt -89.12 89.15 3.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 175.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -82.49 3.11 29.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.873 -174.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 p-80 -166.2 140.99 4.5 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 31.7 m -104.36 176.66 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 120.661 0.267 . . . . 0.0 110.675 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.452 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 0.2 OUTLIER -99.93 -96.68 0.25 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.801 -174.164 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.452 ' H ' ' HB2' ' A' ' 12' ' ' MET . 24.2 mm-40 -146.65 116.27 7.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.286 -177.038 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 48.11 36.84 7.03 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 123.708 0.63 . . . . 0.0 111.917 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.2 m -76.32 125.08 28.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.805 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.658 HG13 ' HD3' ' A' ' 122' ' ' LYS . 2.2 mp -85.49 116.77 29.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 174.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.0 mt -96.71 98.43 7.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.956 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.519 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 45.4 m-80 -86.74 101.48 13.34 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 177.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.478 ' O ' ' HA ' ' A' ' 125' ' ' GLU . 49.7 p90 -103.8 146.48 28.56 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 177.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -150.34 141.58 23.2 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.503 -177.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 96.0 p 60.18 119.72 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.656 1.222 . . . . 0.0 112.358 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.761 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 0.6 OUTLIER -55.44 -64.66 0.77 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.931 178.61 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.3 m 45.87 -95.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.848 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -160.74 34.47 0.15 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 122.059 0.933 . . . . 0.0 108.556 -177.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -126.35 -145.29 0.32 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.167 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.18 -1.42 15.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.424 178.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.761 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -60.64 -0.15 1.24 Allowed Glycine 0 CA--C 1.525 0.697 0 CA-C-N 115.787 -0.642 . . . . 0.0 114.524 -178.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -55.12 -25.48 31.98 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.011 0.905 . . . . 0.0 111.073 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -65.51 -36.95 85.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.763 174.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.0 m -57.32 145.69 31.38 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.511 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -81.22 10.85 4.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.868 -175.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -105.48 6.27 32.25 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.49 0.662 . . . . 0.0 109.481 175.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.526 ' HA ' HG22 ' A' ' 22' ' ' THR . . . -71.43 141.92 50.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.635 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.62 52.53 1.91 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.101 0.477 . . . . 0.0 111.616 -176.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -108.26 106.65 59.04 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.957 177.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -56.48 139.57 87.54 Favored 'Trans proline' 0 C--O 1.238 0.522 0 C-N-CA 123.064 2.509 . . . . 0.0 112.547 -178.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.507 HG21 ' HA ' ' A' ' 104' ' ' LYS . 24.7 pt -119.98 131.66 71.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.746 -178.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -96.62 93.56 6.82 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 44.5 t -102.66 123.61 56.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.85 -176.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 58.99 24.29 12.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.329 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 97.09 3.88 58.82 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.711 176.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.466 ' HD3' ' HA ' ' A' ' 42' ' ' LYS . 25.0 mmtp -128.01 152.12 48.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.133 0.966 . . . . 0.0 111.822 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.0 m -91.63 113.83 26.2 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.557 -171.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.496 ' HB2' HG13 ' A' ' 37' ' ' ILE . 63.4 m95 -101.29 128.53 29.06 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 172.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.55 -39.02 90.25 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.933 2.422 . . . . 0.0 112.521 -176.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.82 171.28 17.97 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.066 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.8 m -69.86 -43.33 72.11 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -172.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.615 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -62.5 -31.7 72.5 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -175.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.452 ' NE2' HG12 ' A' ' 68' ' ' VAL . 19.7 m80 -55.06 -41.85 71.99 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.447 ' CE2' HG13 ' A' ' 96' ' ' VAL . 55.2 t80 -73.07 -40.63 64.89 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.276 178.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.469 ' HA ' HG12 ' A' ' 96' ' ' VAL . 54.2 t80 -61.92 -51.74 66.91 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.977 -179.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.615 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 11.3 mm100 -62.35 -40.09 95.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.946 -177.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.463 ' HB3' ' HB2' ' A' ' 62' ' ' ARG . . . -66.95 -27.6 67.6 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.155 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -84.38 -19.83 32.94 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.542 -177.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -64.28 -52.62 57.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.981 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.556 ' HE1' ' HG3' ' A' ' 83' ' ' LYS . 84.9 m-85 -69.85 153.1 43.76 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -169.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.432 HD11 ' N ' ' A' ' 57' ' ' LEU . 6.0 mp -97.94 -1.45 42.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.883 173.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.642 ' HB2' ' HB2' ' A' ' 61' ' ' TYR . 5.8 m-20 -86.8 110.78 20.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.524 176.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -60.56 -36.46 78.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.116 0.484 . . . . 0.0 109.882 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -62.36 -41.38 98.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.7 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.642 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 1.8 m-85 -64.81 -44.8 88.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.319 -0.4 . . . . 0.0 112.006 -175.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.463 ' HB2' ' HB3' ' A' ' 53' ' ' ALA . 5.1 ptp85 -66.75 -31.16 71.63 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.951 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -70.15 -35.88 74.36 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 174.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -64.7 -40.73 95.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.866 176.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.524 ' HA ' HG13 ' A' ' 68' ' ' VAL . 72.5 mt -71.88 -20.65 20.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.212 0.53 . . . . 0.0 110.525 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -77.7 -10.13 59.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.108 0.48 . . . . 0.0 110.44 173.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -110.75 -28.53 8.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.294 -178.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.524 HG13 ' HA ' ' A' ' 65' ' ' ILE . 13.5 p -62.64 121.38 11.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.53 0.681 . . . . 0.0 111.315 -176.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.1 m -85.09 -12.68 52.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.159 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.1 t -102.23 124.04 41.12 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.056 -177.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.96 -34.45 59.41 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.897 2.398 . . . . 0.0 111.99 177.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 85.2 mmm -66.41 -37.47 85.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.179 -177.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 94.9 t -68.1 -41.23 84.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.539 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.26 91.63 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.37 177.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.451 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -59.61 -42.28 92.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.859 176.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -60.8 -45.11 95.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.021 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 66.8 mtt -57.47 -51.1 70.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.303 0.573 . . . . 0.0 110.728 178.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.497 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -73.23 -14.25 79.21 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.783 -177.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -73.32 -31.34 63.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.68 0.276 . . . . 0.0 110.534 -178.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -64.92 138.01 58.11 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.044 0.45 . . . . 0.0 111.384 -177.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.54 4.64 28.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.639 -177.04 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.1 m -83.44 -31.98 26.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 0.0 110.06 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.556 ' HG3' ' HE1' ' A' ' 56' ' ' PHE . 32.2 mmmt -65.14 146.88 98.86 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.862 177.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.57 148.07 88.97 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.929 2.42 . . . . 0.0 112.598 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 98.2 mt -112.39 159.72 18.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.33 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.684 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 54.4 mtp180 -83.29 153.24 24.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.374 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.13 -34.06 75.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.883 0.373 . . . . 0.0 110.627 179.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.425 ' O ' HG21 ' A' ' 92' ' ' VAL . 10.5 p30 -100.87 12.95 36.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.31 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.684 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 55.0 t-105 -65.81 -17.56 64.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.145 0.498 . . . . 0.0 109.758 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.408 ' OE2' ' HA ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -65.26 -39.48 92.68 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.341 176.673 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.0 p -99.17 -42.49 7.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.454 ' O ' HG23 ' A' ' 96' ' ' VAL . 32.6 m -67.96 -14.03 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -167.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.629 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 35.2 mtmm -51.87 -44.25 63.63 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.096 0.474 . . . . 0.0 111.131 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -80.46 -25.36 38.93 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.624 -175.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.413 ' OE1' ' HA ' ' A' ' 92' ' ' VAL . 1.7 mp0 -70.87 -40.68 72.14 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 174.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.469 HG12 ' HA ' ' A' ' 51' ' ' PHE . 84.3 t -63.96 -48.75 84.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.772 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.3 ttm -70.43 -30.67 67.59 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.303 -178.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.1 ttm-85 -63.9 -38.0 89.46 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -65.22 -42.82 93.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.627 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.91 -48.28 81.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.786 178.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.2 mt -62.46 -46.7 87.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.074 178.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.484 ' HA ' HD21 ' A' ' 152' ' ' LEU . 49.8 ttt85 -59.14 -51.98 67.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.555 -178.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -62.78 -29.85 71.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 0.0 111.151 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.507 ' HA ' HG21 ' A' ' 37' ' ' ILE . 88.3 tttt -64.2 -53.65 45.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.821 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.519 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 86.2 m-85 -77.69 -22.95 49.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.88 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 44.3 mt-10 -72.34 -49.88 30.96 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.128 -0.358 . . . . 0.0 110.917 175.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.2 OUTLIER -71.68 -26.03 62.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.893 -175.918 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -116.52 101.93 9.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.908 0.385 . . . . 0.0 110.111 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.13 75.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.816 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.442 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.4 pm0 -69.41 -30.52 68.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.805 0.336 . . . . 0.0 110.621 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 29.2 mt -74.59 -37.51 62.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.747 ' HG3' HD13 ' A' ' 156' ' ' LEU . 16.5 ttm180 -64.17 -44.29 92.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.924 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.93 -43.91 97.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.375 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.1 tp -57.68 -48.42 79.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.809 176.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.41 HD23 HD11 ' A' ' 156' ' ' LEU . 43.4 tp -57.65 -44.83 85.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.845 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.464 HD23 ' HB2' ' A' ' 156' ' ' LEU . 78.8 mt -69.5 -29.52 67.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.539 -178.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -70.31 -17.34 63.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.705 -178.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 47.5 p -72.61 -35.63 67.89 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.745 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -50.92 133.44 29.2 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.824 -179.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -100.55 38.65 5.21 Favored 'Cis proline' 0 CA--C 1.535 0.574 0 C-N-CA 124.184 -1.173 . . . . 0.0 113.432 1.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -75.1 157.96 33.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.288 0.566 . . . . 0.0 111.099 178.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.658 ' HD3' HG13 ' A' ' 16' ' ' ILE . 86.7 tttt -95.39 122.8 38.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.264 -173.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.3 mt -90.27 119.27 30.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.787 0.327 . . . . 0.0 111.216 -175.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 60.5 t -136.75 119.36 20.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.731 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 19' ' ' PHE . 37.7 tt0 -97.38 116.94 30.54 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 171.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.545 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 1.4 t-80 -87.1 77.11 9.18 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.354 -170.129 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 17.1 m -86.37 107.7 18.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.105 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.9 -28.5 11.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.61 -178.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -55.89 -42.44 75.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.52 177.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -140.42 136.18 32.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.432 -177.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -100.41 87.51 3.42 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.925 0.393 . . . . 0.0 110.844 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -146.55 -45.29 0.19 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.549 ' HB3' HD23 ' A' ' 145' ' ' LEU . 85.9 m95 -131.2 107.27 8.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.434 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 129.15 -149.77 18.65 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.031 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.545 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 3.8 m-20 -73.03 -28.83 62.57 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.97 0.414 . . . . 0.0 111.646 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 70.16 10.17 65.06 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 110.209 -1.156 . . . . 0.0 110.209 -168.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 92.29 -12.51 69.48 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 114.826 -0.687 . . . . 0.0 113.537 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -144.45 0.75 1.03 Allowed 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -174.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 111.28 -50.49 0.77 Allowed Glycine 0 CA--C 1.517 0.196 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.619 178.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -81.45 61.31 4.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.706 0.765 . . . . 0.0 109.955 178.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -132.13 15.21 5.08 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.777 176.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt 70.44 79.61 0.18 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.326 0.584 . . . . 0.0 111.865 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -77.72 5.42 9.4 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.755 0.788 . . . . 0.0 110.12 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.624 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 46.1 mtm105 -62.98 -8.19 6.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.878 -177.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.549 HD23 ' HB3' ' A' ' 133' ' ' TRP . 66.5 tp -66.61 -49.09 67.44 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 168.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -59.09 -37.89 92.28 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 173.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -63.75 -45.81 88.18 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.581 -0.31 . . . . 0.0 110.911 176.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 87.9 mt -56.77 -41.4 77.58 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.887 0.375 . . . . 0.0 110.399 178.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.96 -45.88 91.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.947 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.557 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 75.3 mtm -71.64 -36.57 70.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.235 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -62.81 -49.17 75.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.531 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.484 HD21 ' HA ' ' A' ' 102' ' ' ARG . 48.9 tp -66.16 -34.16 77.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.259 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.409 ' HB3' ' O ' ' A' ' 150' ' ' MET . 62.1 ttp180 -54.4 -48.81 71.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.693 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.557 ' HG2' ' O ' ' A' ' 150' ' ' MET . 5.7 mm-40 -59.96 -39.71 86.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.504 -178.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -63.78 -39.87 95.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.537 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.747 HD13 ' HG3' ' A' ' 112' ' ' ARG . 87.8 mt -78.29 -15.09 59.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.958 -178.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -79.69 -45.57 18.74 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 174.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 154' ' ' GLU . 63.5 mt -60.66 -29.28 44.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.104 177.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . 0.441 ' HB3' ' O ' ' A' ' 156' ' ' LEU . 5.5 tt0 -47.9 -53.83 14.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.408 174.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -80.71 -10.83 59.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.621 -174.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 157' ' ' ALA . 8.2 mp -74.66 -22.01 59.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.022 0.439 . . . . 0.0 110.254 175.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -82.17 5.05 20.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.732 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -63.09 -23.32 67.39 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.852 0.358 . . . . 0.0 110.881 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 51.3 t60 -118.88 26.05 9.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.438 0.637 . . . . 0.0 109.683 -178.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -124.06 -170.3 2.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.058 178.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 31.1 m170 75.58 -72.59 0.1 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.486 0.714 . . . . 0.0 110.359 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -154.65 165.7 35.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.793 0.33 . . . . 0.0 110.766 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.452 -0.785 . . . . 0.0 109.735 176.456 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.4 mtt . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.41 ' O ' ' HG3' ' A' ' 4' ' ' ARG . 3.0 Cg_exo -75.02 107.93 2.6 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.394 2.062 . . . . 0.0 110.873 174.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.3 t -56.5 117.54 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.476 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 2' ' ' PRO . 44.4 mtm180 -115.44 97.2 6.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.314 -176.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.84 94.83 1.08 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 172.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -60.12 124.59 20.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.215 -174.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -95.17 99.93 11.82 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.379 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.66 115.78 20.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.524 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -58.76 -56.56 20.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.973 -177.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -154.1 132.83 12.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.35 -178.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.8 m -77.98 165.18 3.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.379 0.609 . . . . 0.0 111.291 176.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.733 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 13.8 mtt -95.39 50.42 1.24 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.047 -174.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 61.31 -94.88 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.886 -174.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -115.4 74.79 0.9 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.679 0.752 . . . . 0.0 109.317 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.733 ' HB ' ' HB2' ' A' ' 12' ' ' MET . 7.0 t -94.35 154.73 17.34 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.6 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.528 HG12 ' HB2' ' A' ' 122' ' ' LYS . 58.3 mt -111.1 123.6 67.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.029 0.443 . . . . 0.0 110.328 179.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.3 mt -101.7 105.57 18.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.107 -179.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.632 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 20.4 m120 -96.57 123.87 40.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.836 177.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -104.76 147.54 27.59 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.848 0.356 . . . . 0.0 110.863 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.603 ' HE1' ' O ' ' A' ' 126' ' ' HIS . 78.3 m-85 -126.99 114.29 17.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.652 -177.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.8 t 56.46 -150.18 0.44 Allowed 'General case' 0 CA--C 1.534 0.358 0 O-C-N 123.585 0.553 . . . . 0.0 109.702 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.499 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 26.0 p -89.45 -55.91 3.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 173.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.4 m 67.22 -69.68 0.13 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 174.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -129.9 179.75 5.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.181 -168.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -71.99 -27.4 62.73 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -73.38 -6.38 45.86 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.144 172.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.499 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -79.82 0.06 83.46 Favored Glycine 0 C--O 1.23 -0.129 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.653 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.51 ' CG ' ' HZ2' ' A' ' 104' ' ' LYS . 31.5 t70 -49.14 -21.11 0.68 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -59.29 -21.8 60.22 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.947 0.403 . . . . 0.0 111.07 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.2 t -82.11 129.53 34.84 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -78.41 5.16 11.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.865 0.364 . . . . 0.0 111.514 -178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -92.88 -3.17 55.07 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 175.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.16 136.66 52.45 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.925 176.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.68 60.82 4.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.42 0.629 . . . . 0.0 111.067 -174.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -104.02 120.88 49.68 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.591 175.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.449 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 30.8 Cg_endo -64.34 124.24 13.06 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.89 2.393 . . . . 0.0 112.523 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.615 HG21 ' HA ' ' A' ' 104' ' ' LYS . 25.9 pt -113.27 156.34 14.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.516 177.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -111.1 97.11 6.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.99 0.424 . . . . 0.0 110.258 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.524 HG13 ' HD3' ' A' ' 99' ' ' LYS . 87.8 t -119.04 122.85 70.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.23 -174.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 58.71 30.23 19.68 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 123.844 0.715 . . . . 0.0 110.839 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.5 14.82 75.26 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.754 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -126.16 143.13 51.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.894 0.347 . . . . 0.0 110.454 -179.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.3 m -91.5 115.74 28.29 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.348 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.492 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 72.9 m95 -105.23 133.18 20.28 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.926 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.492 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 8.9 Cg_exo -71.67 -11.26 27.76 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 123.071 2.514 . . . . 0.0 113.012 -177.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -165.6 146.6 7.06 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.7 m -57.59 -39.12 76.08 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.319 0.387 . . . . 0.0 111.107 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -61.19 -28.01 68.83 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.675 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.538 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 14.8 m80 -64.37 -44.74 90.41 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.847 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -74.19 -36.76 64.03 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.176 0.512 . . . . 0.0 110.005 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -61.61 -46.76 88.44 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.567 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.549 ' HB3' HD13 ' A' ' 65' ' ' ILE . 0.6 OUTLIER -71.72 -31.17 66.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.482 -178.941 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.97 -45.98 79.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.791 0.329 . . . . 0.0 111.001 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -77.2 -15.15 59.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.881 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.432 ' HB3' ' O ' ' A' ' 52' ' ' GLN . 87.1 tttt -63.22 -34.36 77.49 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.506 177.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -108.24 155.84 20.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.298 -178.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.599 ' H ' HD23 ' A' ' 57' ' ' LEU . 2.5 pt? -108.1 11.84 27.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.13 -177.12 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -95.91 120.38 36.09 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 177.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -57.72 -43.51 85.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.606 -173.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 64' ' ' GLU . 86.3 tttt -64.76 -56.88 10.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.728 -176.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.42 ' CZ ' ' HE2' ' A' ' 83' ' ' LYS . 7.1 t80 -60.61 -35.74 76.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.197 0.522 . . . . 0.0 110.14 -178.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.555 ' HE ' ' HG3' ' A' ' 63' ' ' GLU . 2.6 tmm_? -58.48 -46.25 87.04 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.493 176.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.555 ' HG3' ' HE ' ' A' ' 62' ' ' ARG . 35.4 mt-10 -83.51 -7.17 59.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.917 -177.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 19.0 mm-40 -74.67 -39.32 62.08 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 169.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.549 HD13 ' HB3' ' A' ' 52' ' ' GLN . 54.7 mt -70.6 -26.19 28.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.602 175.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.503 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . 25.7 tpt180 -72.53 -29.58 63.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.506 172.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 25.9 ttm-85 -80.65 -37.41 30.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.889 -175.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.489 HG23 ' HB ' ' A' ' 73' ' ' VAL . 11.1 p -71.41 120.39 19.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.443 0.64 . . . . 0.0 111.332 -176.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.0 t -80.42 -36.19 34.05 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.533 178.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.7 m -69.72 124.35 90.42 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.744 -178.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.538 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 35.4 Cg_endo -65.53 -45.45 6.89 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.866 2.377 . . . . 0.0 113.083 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 25.0 ttt -63.75 -26.05 68.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.586 -174.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.489 ' HB ' HG23 ' A' ' 68' ' ' VAL . 54.2 t -72.53 -36.67 54.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.96 0.41 . . . . 0.0 110.16 178.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.98 -44.35 89.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.88 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.579 ' O ' ' HG2' ' A' ' 79' ' ' ARG . . . -57.45 -48.92 77.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.679 173.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -51.89 -64.06 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.842 -178.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.512 ' HE1' HG12 ' A' ' 65' ' ' ILE . 27.1 ptt? -80.75 -4.88 56.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.134 0.493 . . . . 0.0 111.001 -175.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.52 -25.29 39.65 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 121.033 -0.604 . . . . 0.0 111.923 175.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 75' ' ' ALA . 58.6 mmt-85 -89.72 3.84 51.48 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 177.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.418 ' C ' ' H ' ' A' ' 82' ' ' SER . 14.1 t70 -59.47 -42.85 92.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.798 -177.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 71.25 -15.92 0.39 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.534 0.734 . . . . 0.0 112.341 173.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.418 ' H ' ' C ' ' A' ' 80' ' ' ASP . 13.1 m -90.27 23.61 2.84 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.219 0.533 . . . . 0.0 110.563 -177.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.42 ' HE2' ' CZ ' ' A' ' 61' ' ' TYR . 12.3 mmmt -109.44 162.47 20.07 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 177.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.42 114.47 2.14 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.173 1.915 . . . . 0.0 112.154 178.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 92.5 mt -84.89 154.26 22.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.045 -177.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -82.34 144.8 30.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.957 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -69.39 -51.97 31.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.118 0.485 . . . . 0.0 111.011 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -86.59 27.56 0.95 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.939 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.447 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 41.3 t-105 -62.15 -23.42 66.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.571 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.441 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 40.5 mm-40 -76.18 -18.63 59.0 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.016 178.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.1 m -99.8 -19.13 16.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.858 -177.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.426 ' HA ' ' HB3' ' A' ' 95' ' ' GLN . 28.3 m -111.06 2.11 8.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -168.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 59.4 mttp -60.05 -59.91 4.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.448 0.642 . . . . 0.0 110.424 -179.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.489 ' CD ' ' H ' ' A' ' 94' ' ' GLU . 1.4 pm0 -78.87 -17.19 56.01 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.04 -177.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.426 ' HB3' ' HA ' ' A' ' 92' ' ' VAL . 10.2 tt0 -77.75 -48.28 17.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.484 179.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.419 HG23 ' HB ' ' A' ' 92' ' ' VAL . 68.3 t -64.77 -40.85 90.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 120.963 0.411 . . . . 0.0 109.909 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.8 tpp -60.16 -39.08 85.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.483 177.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -63.59 -40.94 98.23 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.439 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.524 ' HD3' HG13 ' A' ' 39' ' ' VAL . 39.0 ttmt -63.48 -46.51 85.83 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 177.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.61 -43.58 98.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.643 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.676 ' HB3' HD23 ' A' ' 152' ' ' LEU . 35.4 mt -60.13 -49.63 76.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.464 178.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.56 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 32.1 ttt180 -64.84 -45.78 84.68 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.533 -178.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.44 -28.7 68.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.191 0.519 . . . . 0.0 110.786 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.615 ' HA ' HG21 ' A' ' 37' ' ' ILE . 53.9 tttm -70.24 -53.7 15.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.791 179.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -86.82 -0.03 55.69 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -177.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.842 ' HA ' HH21 ' A' ' 112' ' ' ARG . 1.8 mm-40 -92.08 -40.64 10.94 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.628 0.251 . . . . 0.0 110.846 172.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -71.26 -38.89 71.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.947 0.403 . . . . 0.0 110.758 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -109.33 110.19 21.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.155 -175.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.5 -24.03 63.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.176 176.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -58.71 -54.17 50.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.718 176.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 27.9 mt -69.59 -35.53 75.42 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.478 -176.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.842 HH21 ' HA ' ' A' ' 106' ' ' GLU . 42.5 ttm180 -57.37 -47.47 81.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.876 178.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.74 95.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.643 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.0 tp -61.29 -47.53 85.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.507 178.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.27 -45.67 92.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.026 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 156' ' ' LEU . 74.3 mt -68.43 -18.82 64.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.6 -177.395 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -77.9 -7.28 56.51 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 63.5 p -85.3 -32.73 22.36 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.514 -178.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.04 136.36 14.38 Favored Pre-proline 0 N--CA 1.467 0.42 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -100.4 35.54 7.16 Favored 'Cis proline' 0 C--N 1.349 0.567 0 C-N-CA 124.45 -1.063 . . . . 0.0 113.156 -1.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -66.26 149.5 50.26 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.652 0.263 . . . . 0.0 111.222 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.528 ' HB2' HG12 ' A' ' 16' ' ' ILE . 55.7 mttp -79.87 125.38 29.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.735 179.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 53.9 mt -90.62 100.97 13.72 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.632 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 98.8 t -133.45 126.86 52.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.962 -174.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.564 ' CD ' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -83.6 136.59 34.18 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 174.425 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.736 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 72.5 t60 -134.26 77.24 1.69 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.955 0.407 . . . . 0.0 110.051 172.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.564 HG21 ' CD ' ' A' ' 125' ' ' GLU . 8.9 t -112.97 130.46 56.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.292 0.568 . . . . 0.0 109.544 175.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.497 ' HG2' ' CA ' ' A' ' 137' ' ' GLY . 29.2 mt-10 -87.81 12.35 13.2 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.436 -175.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -91.24 -35.24 14.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.583 -178.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -152.44 135.6 15.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.78 0.324 . . . . 0.0 110.864 -177.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.455 ' CB ' ' HA3' ' A' ' 136' ' ' GLY . . . -110.58 91.72 3.77 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.298 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -153.75 -31.15 0.12 Allowed 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.115 -178.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -137.15 36.92 2.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.591 0.234 . . . . 0.0 111.54 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.498 ' HA3' ' CD ' ' A' ' 125' ' ' GLU . . . -174.08 -114.9 0.37 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.162 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.736 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 16.3 t70 -111.62 -33.73 6.27 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.895 0.379 . . . . 0.0 110.866 -176.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.455 ' HA3' ' CB ' ' A' ' 131' ' ' ALA . . . 74.2 6.5 74.85 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.031 177.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.497 ' CA ' ' HG2' ' A' ' 128' ' ' GLU . . . 78.7 40.69 17.26 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.917 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -178.02 -22.68 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . 0.422 ' HA2' ' OD2' ' A' ' 135' ' ' ASP . . . 127.28 -44.11 1.27 Allowed Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.222 -0.989 . . . . 0.0 113.043 174.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -91.37 68.39 5.83 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.778 0.799 . . . . 0.0 109.163 -177.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.413 ' HA2' ' HB2' ' A' ' 131' ' ' ALA . . . -123.1 14.89 8.31 Favored Glycine 0 C--N 1.311 -0.838 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.842 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 75.8 mttt 61.74 69.77 0.62 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.28 0.562 . . . . 0.0 111.732 173.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.467 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 7.6 t30 -72.92 5.54 3.21 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.337 -174.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.582 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 77.8 mtm-85 -48.07 -24.21 1.03 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 50.7 tp -57.25 -56.05 26.77 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.656 0.265 . . . . 0.0 110.764 174.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.545 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -64.49 -30.43 77.85 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 121.282 -0.485 . . . . 0.0 111.895 178.008 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -64.58 -42.3 95.69 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 95.3 mt -61.5 -41.24 96.98 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.095 175.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.87 -38.77 89.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.025 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 63.9 mtt -60.46 -51.25 70.26 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.162 0.506 . . . . 0.0 110.217 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -64.6 -41.02 96.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.849 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.676 HD23 ' HB3' ' A' ' 101' ' ' LEU . 54.7 tp -62.34 -42.04 99.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 178.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -59.48 -56.27 24.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.539 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.6 -32.99 70.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.049 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -64.25 -40.03 95.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.789 177.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.495 ' HB2' HD22 ' A' ' 116' ' ' LEU . 96.0 mt -77.69 -22.98 49.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.985 0.421 . . . . 0.0 110.613 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.41 -50.37 26.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.045 174.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 80.7 mt -65.05 -26.25 39.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.402 178.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -52.76 -40.72 63.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.602 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -74.58 -30.62 61.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.827 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.7 mp -70.75 -33.54 70.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.215 0.531 . . . . 0.0 110.361 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -79.4 -34.34 41.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.176 174.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 14.1 p80 40.86 49.84 2.96 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.806 0.842 . . . . 0.0 111.35 -178.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -149.96 85.43 1.41 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.704 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -81.24 169.01 17.87 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.577 -173.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -63.23 144.72 56.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.334 177.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 34.2 t-80 -64.45 -28.3 69.58 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.045 -177.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 19.2 m80 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 118.597 -0.715 . . . . 0.0 109.216 174.002 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -71.36 -28.37 18.25 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.346 2.031 . . . . 0.0 110.89 171.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 40.4 t -82.89 137.84 20.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.799 178.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.804 ' HB2' ' HB3' ' A' ' 25' ' ' ASP . 21.6 ttt180 -128.04 50.5 2.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.107 0.48 . . . . 0.0 110.249 177.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.457 ' HA ' HD13 ' A' ' 114' ' ' LEU . . . -74.84 58.63 0.84 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.562 0.696 . . . . 0.0 110.063 174.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -87.54 129.15 35.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.627 -177.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.484 ' O ' ' HG3' ' A' ' 7' ' ' ARG . 34.8 ptt180 -64.96 106.25 1.2 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.47 0.652 . . . . 0.0 111.324 -177.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.403 ' H ' ' HB3' ' A' ' 117' ' ' ALA . 57.1 mt -87.0 86.15 2.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 174.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.33 11.46 37.93 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.773 -179.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 35.7 t-80 -138.83 94.6 2.84 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.246 176.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.622 ' HB ' ' HG1' ' A' ' 15' ' ' THR . 33.3 m -99.74 170.56 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.49 ' HE1' HG22 ' A' ' 15' ' ' THR . 42.3 mtt -72.67 -74.53 0.16 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.618 0.723 . . . . 0.0 109.695 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -175.71 -56.45 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.955 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -125.59 72.59 1.28 Allowed 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.26 -1.337 . . . . 0.0 107.648 168.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.622 ' HG1' ' HB ' ' A' ' 11' ' ' VAL . 4.2 m -76.62 154.54 34.26 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.622 -170.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.9 mm -115.79 124.11 71.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 45.5 mm -106.9 101.72 12.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.029 178.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -100.48 104.43 15.82 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -118.01 137.98 52.51 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.45 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.57 ' CE1' ' HA ' ' A' ' 127' ' ' THR . 8.9 t80 -150.28 149.33 29.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.486 176.336 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.5 p 66.61 154.01 0.08 Allowed 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.669 1.188 . . . . 0.0 111.941 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.533 HG22 ' HA ' ' A' ' 33' ' ' ALA . 1.8 m -93.98 0.23 55.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.539 0.685 . . . . 0.0 109.841 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m -75.12 -32.15 61.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.397 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.83 161.03 24.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.468 177.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.804 ' HB3' ' HB2' ' A' ' 4' ' ' ARG . 2.8 m-20 -68.05 -24.68 65.1 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.637 -176.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -76.37 -1.36 26.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.788 175.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.452 ' O ' ' HB3' ' A' ' 30' ' ' SER . . . -65.98 -3.27 16.06 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.808 -0.633 . . . . 0.0 113.176 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -61.63 -30.29 70.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.122 0.461 . . . . 0.0 110.553 174.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -72.94 -23.82 60.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.852 177.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 27' ' ' GLY . 29.2 t -58.83 138.1 57.42 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.464 0.649 . . . . 0.0 111.48 -176.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -72.93 -17.09 61.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.705 177.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -90.51 -5.62 55.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.365 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.533 ' HA ' HG22 ' A' ' 22' ' ' THR . . . -64.0 146.86 53.36 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.832 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.38 59.22 3.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.268 0.556 . . . . 0.0 111.719 -174.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -109.99 109.7 59.05 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.993 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.53 139.08 68.41 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.703 2.268 . . . . 0.0 112.178 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.502 HG23 ' HA ' ' A' ' 104' ' ' LYS . 27.2 pt -124.86 138.31 54.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.018 0.437 . . . . 0.0 111.275 -177.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.553 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 50.0 tptt -97.66 106.59 18.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 t -126.44 126.84 69.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.45 -174.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 54.71 23.74 5.03 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 124.043 0.84 . . . . 0.0 112.141 173.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.04 -14.67 31.26 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.667 -0.777 . . . . 0.0 113.416 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -121.52 153.73 37.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.913 0.857 . . . . 0.0 111.322 -175.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 12.1 m -99.41 108.66 21.2 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.214 -176.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.46 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 48.3 m95 -97.99 135.18 21.54 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.607 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.576 ' O ' HG23 ' A' ' 46' ' ' THR . 11.4 Cg_exo -71.78 57.46 2.51 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.788 2.326 . . . . 0.0 112.412 176.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.576 HG23 ' O ' ' A' ' 45' ' ' PRO . 0.7 OUTLIER 92.98 170.11 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.672 1.589 . . . . 0.0 112.708 172.436 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 m -49.33 -47.82 46.93 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 114.33 -1.304 . . . . 0.0 112.517 -172.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -54.38 -33.53 59.38 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.917 0.389 . . . . 0.0 111.604 -175.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.4 ' CE1' ' HB2' ' A' ' 45' ' ' PRO . 44.7 m80 -75.66 -43.57 46.91 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 122.057 -0.402 . . . . 0.0 110.822 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.421 ' HA ' ' HB1' ' A' ' 53' ' ' ALA . 42.9 t80 -70.29 -26.28 63.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.952 0.406 . . . . 0.0 110.396 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.476 ' HA ' HG13 ' A' ' 96' ' ' VAL . 27.3 t80 -62.81 -52.87 61.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.512 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.729 ' HB3' HD12 ' A' ' 65' ' ' ILE . 2.4 mp0 -62.97 -34.39 77.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.594 174.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.659 ' HA ' ' HG2' ' A' ' 62' ' ' ARG . . . -65.72 -29.02 69.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.707 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.436 ' HA ' HE21 ' A' ' 54' ' ' GLN . 0.0 OUTLIER -105.41 2.92 29.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.124 0.487 . . . . 0.0 110.06 178.602 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -83.71 -57.94 3.01 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.214 174.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.563 ' CE1' ' HB2' ' A' ' 83' ' ' LYS . 57.0 m-85 -88.02 143.24 27.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.505 -179.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.685 ' H ' HD22 ' A' ' 57' ' ' LEU . 2.5 pt? -102.08 8.71 40.74 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.631 0.253 . . . . 0.0 111.657 -175.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -89.43 121.74 31.96 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.27 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -59.03 -44.86 91.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.443 -176.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -68.47 -52.73 29.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.508 -174.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -67.28 -30.74 70.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.857 0.36 . . . . 0.0 110.864 -178.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.659 ' HG2' ' HA ' ' A' ' 53' ' ' ALA . 5.3 tmm_? -68.67 -34.46 75.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.298 0.57 . . . . 0.0 109.5 177.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -67.18 -27.76 67.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.534 175.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 67' ' ' ARG . 1.3 tp10 -72.74 -28.61 62.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.231 176.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.729 HD12 ' HB3' ' A' ' 52' ' ' GLN . 37.9 mt -77.05 -22.24 14.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.276 0.56 . . . . 0.0 110.595 177.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -76.69 -19.74 57.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 170.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.416 ' HB3' ' O ' ' A' ' 64' ' ' GLU . 7.3 tpp180 -75.78 -43.53 46.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.605 -179.291 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.7 p -63.86 120.34 10.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.334 0.588 . . . . 0.0 110.423 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.2 m -86.0 -31.72 21.89 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.289 -177.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 35.5 t -72.32 123.37 89.41 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.77 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 17.0 Cg_exo -67.8 -34.41 24.35 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.74 2.293 . . . . 0.0 111.652 177.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.82 ' HE2' ' HA ' ' A' ' 72' ' ' MET . 2.2 tpt -67.48 -47.25 70.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.521 -178.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.8 t -65.3 -37.48 80.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.46 -47.55 83.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.83 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.541 ' O ' ' HG3' ' A' ' 79' ' ' ARG . . . -66.7 -41.13 88.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.443 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.3 tpt180 -55.3 -53.73 52.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.032 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.506 ' HE1' HG12 ' A' ' 65' ' ' ILE . 24.6 ptt? -80.2 -23.78 40.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.815 0.34 . . . . 0.0 110.775 -178.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.56 -8.24 85.91 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.955 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.541 ' HG3' ' O ' ' A' ' 75' ' ' ALA . 89.7 mtt180 -89.34 -6.83 56.34 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 122.392 -0.475 . . . . 0.0 110.921 175.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -71.87 125.26 26.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.011 0.434 . . . . 0.0 109.955 176.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.652 ' HG3' HD12 ' A' ' 85' ' ' LEU . 14.5 ttm180 -96.9 15.58 21.82 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.554 -174.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.1 m -91.74 -8.04 48.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.931 178.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.563 ' HB2' ' CE1' ' A' ' 56' ' ' PHE . 45.2 mmtm -88.77 162.32 38.99 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.422 176.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.516 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 51.5 Cg_endo -68.7 100.92 0.72 Allowed 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 121.883 1.722 . . . . 0.0 112.532 -178.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.652 HD12 ' HG3' ' A' ' 81' ' ' ARG . 97.1 mt -84.35 150.13 25.58 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.686 174.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -82.28 143.35 31.38 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 174.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -57.99 -31.43 66.92 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -169.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -104.6 21.99 15.81 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 121.031 -0.268 . . . . 0.0 111.296 -176.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.434 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 43.3 t-105 -58.43 -48.53 80.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.451 -177.117 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.947 ' HA ' ' HE3' ' A' ' 93' ' ' LYS . 1.0 OUTLIER -55.99 -23.38 32.3 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -177.164 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.0 p -99.91 -17.37 17.62 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.9 m -105.53 7.05 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.947 ' HE3' ' HA ' ' A' ' 90' ' ' GLU . 97.6 mttt -59.5 -41.9 90.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.086 0.47 . . . . 0.0 111.061 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.487 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 5.0 pt-20 -73.0 -24.33 60.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.161 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -72.3 -43.36 64.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.162 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.476 HG13 ' HA ' ' A' ' 51' ' ' PHE . 62.7 t -62.12 -38.64 81.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.197 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 21.8 mmt -59.62 -38.84 82.41 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.814 176.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 94' ' ' GLU . 81.7 mtt180 -59.05 -44.97 91.87 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.996 0.427 . . . . 0.0 110.773 177.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 tmtp? -66.72 -49.52 65.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.575 -178.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.26 68.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.72 -176.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.488 HD13 HD22 ' A' ' 149' ' ' LEU . 41.7 mt -64.58 -36.14 83.26 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -177.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.538 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 70.8 ttt180 -65.09 -53.62 42.7 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.784 177.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.44 -32.93 67.4 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.99 0.424 . . . . 0.0 110.82 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.502 ' HA ' HG23 ' A' ' 37' ' ' ILE . 58.7 tttp -54.51 -52.78 60.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.958 175.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -82.42 -30.92 29.85 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.602 ' HA ' ' NH2' ' A' ' 112' ' ' ARG . 28.6 mm-40 -63.46 -49.15 74.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.59 0.233 . . . . 0.0 111.604 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.553 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 79.6 mm-40 -74.47 -20.88 59.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -175.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -116.1 105.02 12.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.808 0.337 . . . . 0.0 111.17 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.54 -27.75 69.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.194 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -57.17 -51.27 70.0 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.69 175.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 67.2 mt -73.05 -39.18 66.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.958 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.602 ' NH2' ' HA ' ' A' ' 106' ' ' GLU . 35.1 ttm-85 -57.9 -44.73 86.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.856 0.36 . . . . 0.0 110.569 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.27 -41.26 94.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.806 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.457 HD13 ' HA ' ' A' ' 5' ' ' ALA . 57.8 tp -62.53 -41.83 99.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.54 178.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 62.0 tp -65.16 -40.25 94.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.892 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.455 HD21 ' HB2' ' A' ' 156' ' ' LEU . 43.3 mt -81.05 -6.41 58.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.772 0.32 . . . . 0.0 111.042 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.403 ' HB3' ' H ' ' A' ' 8' ' ' ILE . . . -85.31 -31.99 22.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.069 177.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.9 p -72.9 -21.82 60.84 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.211 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.509 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -52.48 139.0 39.29 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.439 178.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . 0.501 ' HD2' HG21 ' A' ' 11' ' ' VAL . 41.2 Cg_endo -100.1 40.66 4.16 Favored 'Cis proline' 0 CA--C 1.534 0.519 0 C-N-CA 124.371 -1.095 . . . . 0.0 113.241 -0.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.51 ' CB ' ' HB ' ' A' ' 15' ' ' THR . . . -66.77 154.69 40.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.302 0.572 . . . . 0.0 112.108 -177.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.51 ' HZ1' ' HB2' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -82.31 119.21 23.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.61 179.484 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 23.3 mt -86.31 112.78 21.73 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.804 0.335 . . . . 0.0 110.67 -176.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.8 t -129.13 127.24 65.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.073 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -97.55 129.19 44.71 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -91.22 77.36 5.95 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.57 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -77.57 86.22 3.9 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.966 -177.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -76.62 -18.25 58.71 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.769 -175.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -90.53 -29.88 17.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.622 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.43 ' O ' ' HB ' ' A' ' 127' ' ' THR . 8.9 t70 -145.51 138.87 26.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.816 -172.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.523 ' HB2' ' HA2' ' A' ' 141' ' ' GLY . . . -99.86 86.01 3.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 176.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -151.7 -34.87 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.954 -177.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.622 ' HB3' HD23 ' A' ' 145' ' ' LEU . 71.1 m95 -119.12 -0.23 11.12 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -172.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -155.39 -120.83 0.72 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 119.631 -1.271 . . . . 0.0 113.19 -172.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.513 ' HB2' ' HA2' ' A' ' 139' ' ' GLY . 1.2 p-10 -105.54 -10.21 17.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.957 0.408 . . . . 0.0 110.83 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 72.2 12.32 76.03 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.52 174.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 80.2 19.57 69.17 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.879 -178.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -163.42 19.21 0.07 Allowed 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . 0.513 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 79.86 -0.44 82.49 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 120.579 -0.82 . . . . 0.0 114.306 174.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -138.2 72.02 1.4 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.445 0.623 . . . . 0.0 110.121 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.523 ' HA2' ' HB2' ' A' ' 131' ' ' ALA . . . -129.07 15.15 5.88 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.558 -172.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.439 ' C ' ' H ' ' A' ' 144' ' ' ARG . 33.0 tttm 68.17 80.35 0.2 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.0 0.905 . . . . 0.0 110.523 179.197 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.38 5.33 1.81 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 114.363 -1.29 . . . . 0.0 110.906 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.649 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 24.5 ttt180 -48.09 -26.83 2.0 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.201 0.6 . . . . 0.0 112.576 -176.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.622 HD23 ' HB3' ' A' ' 133' ' ' TRP . 37.6 tp -64.22 -48.57 75.35 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.058 0.456 . . . . 0.0 110.108 178.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -64.76 -29.05 74.21 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.549 177.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -70.2 -38.8 75.4 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 176.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 89.5 mt -58.26 -49.82 75.77 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.249 0.547 . . . . 0.0 109.531 174.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.488 HD22 HD13 ' A' ' 101' ' ' LEU . 96.4 mt -65.21 -31.3 72.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.881 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.6 tpp -61.92 -53.04 61.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.085 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -69.26 -33.97 74.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.538 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.407 ' O ' ' HG2' ' A' ' 155' ' ' GLN . 61.7 tp -60.74 -46.14 91.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.058 0.456 . . . . 0.0 110.071 175.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.509 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 54.0 ttp85 -58.83 -49.54 77.32 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.029 177.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.467 ' O ' HG13 ' A' ' 158' ' ' ILE . 44.4 mt-10 -71.66 -32.04 67.47 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -176.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 152' ' ' LEU . 9.3 pt20 -71.66 -32.19 67.64 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.427 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.455 ' HB2' HD21 ' A' ' 116' ' ' LEU . 84.5 mt -73.78 -25.81 60.32 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.45 ' O ' ' HB3' ' A' ' 160' ' ' LYS . . . -72.18 -43.64 64.24 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.055 173.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.494 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 87.2 mt -62.91 -42.91 98.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 175.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -58.14 -31.35 67.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.107 175.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.967 ' HA ' ' HE3' ' A' ' 160' ' ' LYS . 0.4 OUTLIER -66.86 -40.28 87.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.929 177.26 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.32 -23.31 65.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.666 177.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 158' ' ' ILE . 22.7 mm-40 -85.57 10.93 11.79 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.167 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.51 128.57 36.79 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.284 0.564 . . . . 0.0 111.638 -178.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -159.31 -23.09 0.07 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.518 178.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.43 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 5.1 m170 -125.6 80.07 1.87 Allowed 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 178.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.43 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 67.9 t60 -178.33 -101.28 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.225 171.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -155.55 -65.29 0.12 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -179.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 . . . . . 0 C--O 1.244 0.814 0 CA-C-N 115.095 -0.957 . . . . 0.0 108.475 171.336 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.8 mtp . . . . . 0 N--CA 1.48 1.038 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.29 162.87 39.38 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.196 1.931 . . . . 0.0 111.213 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.5 t -76.17 -32.76 23.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 4' ' ' ARG . 24.8 ttp85 60.23 54.02 4.19 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.19 178.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.1 77.66 4.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.228 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -75.48 116.99 16.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.953 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -100.5 135.46 41.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.333 -177.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.9 mt -63.26 145.52 13.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 173.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 -56.15 -54.36 46.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.365 0.602 . . . . 0.0 109.472 -178.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -167.87 139.64 3.0 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.292 174.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.0 m -59.46 146.7 9.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.277 0.56 . . . . 0.0 111.308 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.4 mtm -94.14 22.66 5.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.391 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 68.42 -70.05 0.14 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.549 -173.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -77.9 44.79 0.48 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.88 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.9 m -97.75 113.32 25.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.625 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.7 mt -111.41 105.75 19.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 176.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 71.3 mt -92.67 102.02 13.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.728 -173.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.584 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 6.2 p30 -103.19 133.94 47.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.674 177.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -140.39 141.54 35.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.035 -175.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.65 ' O ' ' HB2' ' A' ' 21' ' ' SER . 6.6 t80 -150.27 100.22 2.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.182 165.083 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.65 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 6.0 t 150.19 110.7 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 124.85 1.344 . . . . 0.0 108.013 179.186 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.684 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 2.9 m -74.43 -70.26 0.41 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.1 m 47.46 -92.57 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.805 0.842 . . . . 0.0 113.087 174.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -157.24 27.27 0.3 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.524 0.678 . . . . 0.0 109.246 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.412 ' HA ' ' NH2' ' A' ' 4' ' ' ARG . 3.6 t70 -117.94 -153.16 0.52 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.166 -173.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -66.84 -1.31 3.78 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.018 0.437 . . . . 0.0 111.165 177.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.684 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -65.48 -0.45 6.29 Favored Glycine 0 C--O 1.225 -0.44 0 CA-C-N 115.749 -0.66 . . . . 0.0 113.504 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -56.48 -26.87 55.53 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 117.296 0.548 . . . . 0.0 111.315 175.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -66.55 -24.91 66.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.625 177.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.4 m -69.41 128.97 38.44 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 174.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 -76.09 10.52 1.89 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -172.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -95.01 2.2 55.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.223 0.535 . . . . 0.0 109.65 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.24 129.76 41.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.872 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.431 ' HA ' HG21 ' A' ' 46' ' ' THR . . . -86.8 62.89 7.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.414 0.626 . . . . 0.0 111.037 -174.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -102.15 125.51 36.36 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.563 175.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -61.61 116.78 3.65 Favored 'Trans proline' 0 C--O 1.239 0.563 0 C-N-CA 122.377 2.051 . . . . 0.0 111.119 174.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.568 HG21 ' HA ' ' A' ' 104' ' ' LYS . 26.1 pt -116.94 132.77 65.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.963 -178.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.545 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 5.0 tppp? -91.76 103.85 16.36 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 177.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.7 t -121.31 115.21 45.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.676 -177.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 64.64 14.82 9.3 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.568 176.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 114.57 -12.56 20.96 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.114 177.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -110.43 143.86 40.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 117.282 0.541 . . . . 0.0 111.564 -177.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.7 m -92.72 103.62 15.97 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.189 178.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.41 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 66.4 m95 -91.18 134.29 30.18 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 5.1 Cg_exo -76.44 -1.36 11.42 Favored 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 123.05 2.5 . . . . 0.0 112.743 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.431 HG21 ' HA ' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -169.73 150.31 3.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.202 -178.704 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.9 m -58.1 -40.68 81.78 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.318 0.386 . . . . 0.0 110.426 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 14.4 tp10 -57.68 -31.32 66.23 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.511 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.4 ' NE2' HG12 ' A' ' 68' ' ' VAL . 10.2 m80 -64.96 -43.9 91.15 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 122.074 -0.391 . . . . 0.0 111.138 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -72.3 -35.28 68.62 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 177.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.566 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 1.7 t80 -60.3 -46.5 89.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.557 177.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.58 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 79.2 mm-40 -57.88 -46.19 85.25 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.444 175.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.95 -33.4 68.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.521 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.413 ' HB3' ' HZ3' ' A' ' 89' ' ' TRP . 1.6 tp-100 -92.13 -14.58 28.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.741 -178.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.566 ' HG3' ' O ' ' A' ' 51' ' ' PHE . 91.8 mttt -67.73 -38.52 83.65 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.044 0.45 . . . . 0.0 111.141 178.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -110.45 139.41 45.7 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.844 -174.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.76 HD21 ' H ' ' A' ' 57' ' ' LEU . 1.8 pt? -89.53 -7.87 53.99 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.626 -175.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -73.03 138.83 46.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.949 0.404 . . . . 0.0 110.714 -177.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -72.0 -39.48 69.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.781 -175.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -82.86 -36.03 25.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.793 0.33 . . . . 0.0 110.54 -174.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.517 ' O ' HG12 ' A' ' 65' ' ' ILE . 4.9 t80 -66.52 -37.66 85.51 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.138 178.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 38.4 ttp-105 -66.78 -37.62 84.93 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.662 0.744 . . . . 0.0 109.696 174.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 34.0 tt0 -63.27 -33.19 74.97 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.294 175.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.41 ' OE2' ' HD2' ' A' ' 67' ' ' ARG . 5.7 tp10 -69.25 -36.1 76.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.965 177.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.517 HG12 ' O ' ' A' ' 61' ' ' TYR . 50.3 mm -60.66 -34.11 57.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.391 176.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -65.36 -32.92 74.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.973 175.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.448 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 45.9 mtt180 -81.7 -33.2 31.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.789 -172.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.4 HG12 ' NE2' ' A' ' 49' ' ' HIS . 7.2 p -68.8 112.57 3.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.351 0.596 . . . . 0.0 111.482 -176.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.6 m -71.98 -40.38 68.63 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.01 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.416 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 19.4 m -81.45 132.95 54.07 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.719 -173.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 20.9 Cg_exo -67.03 -44.18 5.52 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 123.179 2.586 . . . . 0.0 112.943 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.3 tpt -67.63 -36.8 81.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.753 0.311 . . . . 0.0 110.947 -173.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 67.2 t -62.71 -43.15 98.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.304 178.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.28 -43.43 91.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.399 177.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.64 -39.9 95.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.891 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.471 ' C ' ' HD3' ' A' ' 76' ' ' ARG . 1.9 tmt_? -61.52 -53.88 50.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.711 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.419 ' HE1' HD13 ' A' ' 65' ' ' ILE . 27.2 ptt? -74.48 -15.61 60.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.777 0.322 . . . . 0.0 111.178 -176.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.58 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -93.94 -5.32 62.69 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.341 175.176 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 44.2 ttt180 -98.79 -5.84 30.44 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -81.54 118.92 23.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.686 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 34.0 ttm105 -92.95 66.73 4.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.503 0.668 . . . . 0.0 110.604 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 95.0 p -138.69 8.0 2.56 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.707 0.765 . . . . 0.0 109.06 167.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -99.99 160.05 28.22 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.535 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.46 101.61 0.54 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.151 1.9 . . . . 0.0 111.509 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 69.0 mt -77.5 136.82 38.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.899 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.508 ' HB3' ' HB2' ' A' ' 89' ' ' TRP . 16.8 ttt180 -66.98 131.81 46.64 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.136 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.423 ' HD2' ' HA ' ' A' ' 87' ' ' LYS . 20.1 tptp -62.9 -52.15 64.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.813 -172.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -89.64 20.34 4.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.501 0.191 . . . . 0.0 111.279 -177.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.508 ' HB2' ' HB3' ' A' ' 86' ' ' ARG . 63.7 t-105 -59.8 -33.35 71.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.947 0.403 . . . . 0.0 110.167 177.52 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.18 -40.65 77.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.333 179.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.5 p -85.82 -9.77 56.51 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -174.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.423 HG23 ' HA ' ' A' ' 89' ' ' TRP . 34.5 m -119.24 -4.43 10.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -176.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -53.21 -44.35 67.95 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.042 0.448 . . . . 0.0 111.676 -176.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -83.28 -20.36 34.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.294 -175.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -75.43 -43.55 49.2 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 61.0 t -64.07 -41.89 93.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.99 177.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 52.6 tpp -58.51 -47.28 84.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.709 175.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -61.48 -42.78 99.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.954 -178.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.7 tttp -65.89 -45.36 82.3 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.817 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.55 -41.99 92.37 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.951 0.405 . . . . 0.0 110.73 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.451 ' HB3' HD21 ' A' ' 152' ' ' LEU . 17.5 mt -58.62 -48.65 80.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.309 177.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.9 ttt85 -58.97 -40.92 86.22 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.711 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.23 -37.15 82.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.126 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.568 ' HA ' HG21 ' A' ' 37' ' ' ILE . 27.1 ttpp -65.69 -42.69 90.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.64 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.603 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 82.3 m-85 -82.5 -24.12 34.32 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -77.74 -41.25 38.33 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 121.867 -0.521 . . . . 0.0 111.112 176.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.69 HE21 ' N ' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -83.31 -11.06 58.11 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.513 -176.276 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -129.24 105.25 8.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.048 0.451 . . . . 0.0 109.937 173.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.49 -30.32 70.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.025 -174.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -69.49 -34.2 73.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.814 0.34 . . . . 0.0 110.397 -179.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 36.2 mt -73.0 -38.19 66.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.611 177.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.603 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 22.7 ttm180 -59.8 -46.36 89.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.178 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.09 97.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.843 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.6 tp -58.13 -50.92 71.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.465 176.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 51.3 tp -58.74 -51.29 70.59 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.546 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 112' ' ' ARG . 31.3 mt -68.5 -22.33 64.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.604 -174.05 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -78.26 -11.91 59.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.842 -178.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 68.8 p -80.52 -29.07 37.24 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.944 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -50.84 135.18 27.66 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.951 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -100.45 27.18 15.21 Favored 'Cis proline' 0 N--CA 1.458 -0.562 0 C-N-CA 124.338 -1.109 . . . . 0.0 113.2 0.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -58.57 150.94 21.67 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 120.92 0.39 . . . . 0.0 111.725 -177.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -87.29 117.71 26.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.49 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 31.6 mt -88.04 127.4 35.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.07 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.584 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 1.8 p -142.85 119.18 5.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.211 0.529 . . . . 0.0 111.007 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -91.57 131.52 36.93 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -91.99 77.13 5.43 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 119.544 -0.862 . . . . 0.0 108.767 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.73 86.13 5.35 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.544 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -85.96 -15.62 40.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.073 -176.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -82.98 -25.43 32.27 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.204 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -152.05 129.65 11.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.594 -176.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.491 ' HB3' ' HA2' ' A' ' 141' ' ' GLY . . . -100.03 85.71 3.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.867 -178.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -158.96 -26.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -177.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.506 ' HB3' HD21 ' A' ' 145' ' ' LEU . 49.1 m95 -131.52 22.01 4.72 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -168.01 -134.27 1.69 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 119.319 -1.42 . . . . 0.0 113.695 -177.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -76.09 -34.45 59.52 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.076 0.465 . . . . 0.0 111.095 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.494 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 79.67 -2.4 73.5 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.651 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 84.93 9.91 79.8 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 121.277 -0.487 . . . . 0.0 112.499 179.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . 0.456 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 30.0 p80 -168.19 23.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.525 0.203 . . . . 0.0 111.103 -178.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 88.14 -51.45 4.0 Favored Glycine 0 CA--C 1.522 0.473 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.591 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.456 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 95.1 mttt -84.53 62.64 7.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.697 0.761 . . . . 0.0 110.655 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.494 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -123.41 15.25 8.13 Favored Glycine 0 C--N 1.315 -0.627 0 CA-C-N 115.221 -0.899 . . . . 0.0 112.548 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.408 ' C ' ' H ' ' A' ' 144' ' ' ARG . 11.1 mptt 63.02 71.33 0.52 Allowed 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 122.962 0.505 . . . . 0.0 111.506 172.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.553 ' OD1' HG23 ' A' ' 124' ' ' VAL . 6.3 t30 -71.92 5.71 2.47 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.284 -178.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.455 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 2.6 mpt_? -49.89 -22.05 1.37 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -179.018 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.506 HD21 ' HB3' ' A' ' 133' ' ' TRP . 62.8 tp -59.23 -45.5 90.98 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.613 0.244 . . . . 0.0 110.598 175.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.594 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -63.52 -30.83 78.77 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.751 176.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -71.77 -36.97 70.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 98.2 mt -62.14 -36.79 82.86 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 174.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.34 -38.81 92.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.337 174.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.594 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 58.1 mtt -64.04 -46.53 84.01 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 177.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -56.54 -51.08 69.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.583 177.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.451 HD21 ' HB3' ' A' ' 101' ' ' LEU . 56.4 tp -63.55 -48.42 77.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.879 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -56.77 -41.07 76.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.872 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.446 ' O ' HG13 ' A' ' 158' ' ' ILE . 1.4 tp10 -61.39 -52.54 64.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.151 -178.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -65.34 -35.48 81.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.53 -175.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.455 ' HB2' HD21 ' A' ' 116' ' ' LEU . 87.4 mt -72.47 -35.01 68.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.856 0.36 . . . . 0.0 110.317 179.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.401 ' O ' HD12 ' A' ' 161' ' ' LEU . . . -68.43 -47.85 66.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.506 177.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 154' ' ' GLU . 73.4 mt -62.24 -37.95 79.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.422 179.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -63.3 -31.8 73.05 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.34 0.59 . . . . 0.0 110.09 177.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -82.77 -12.27 57.64 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.716 179.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 157' ' ' ALA . 7.8 mp -96.51 -35.55 11.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.839 177.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.25 -37.02 79.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.874 -177.177 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.453 ' HB2' ' HB2' ' A' ' 167' ' ' HIS . 9.4 p80 -74.18 0.33 14.34 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.85 -174.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -61.81 -31.53 71.77 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.187 0.518 . . . . 0.0 109.797 177.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -117.08 -64.95 1.24 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.473 0.654 . . . . 0.0 109.471 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -80.12 98.17 7.18 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.872 -176.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . 0.453 ' HB2' ' HB2' ' A' ' 163' ' ' HIS . 34.3 t-80 177.81 -29.22 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.012 179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 . . . . . 0 C--O 1.246 0.912 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.474 179.664 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.478 0.955 0 CA-C-O 120.596 0.236 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.88 95.56 0.97 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.337 2.025 . . . . 0.0 111.255 175.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.453 ' HA ' ' CG ' ' A' ' 25' ' ' ASP . 56.8 t -55.69 113.93 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.955 -174.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.413 HH21 ' CG ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -83.65 86.45 7.12 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 173.908 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.64 76.55 10.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.066 -175.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -85.7 84.21 7.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.267 0.556 . . . . 0.0 109.706 176.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -95.05 106.91 18.95 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.675 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 21.1 mt -80.44 83.39 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.281 -171.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -70.87 -19.12 62.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.412 0.625 . . . . 0.0 109.807 176.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -107.96 71.53 0.81 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.626 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 5.5 m -83.47 149.62 4.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 171.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.406 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 0.6 OUTLIER -66.21 -80.21 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.072 -176.645 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.406 ' H ' ' HB2' ' A' ' 12' ' ' MET . 49.2 tt0 -169.32 83.38 0.13 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 173.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.3 t70 62.9 99.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.968 0.793 . . . . 0.0 110.114 -173.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.9 t -120.56 148.08 44.33 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.607 HG13 ' HD2' ' A' ' 122' ' ' LYS . 3.9 mp -86.34 104.74 14.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.968 0.413 . . . . 0.0 110.049 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.6 mt -90.03 89.93 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-O 121.281 0.562 . . . . 0.0 109.881 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.508 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.4 p30 -84.16 102.06 12.3 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 171.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -100.7 137.27 39.32 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.625 -171.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -150.72 -179.34 7.18 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.578 175.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 48.2 m 66.48 93.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.671 0.748 . . . . 0.0 110.666 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.452 HG22 ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -81.39 3.41 24.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.962 -176.025 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 m -46.12 -47.47 17.39 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.348 -0.842 . . . . 0.0 113.255 -175.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.413 ' CG ' HH21 ' A' ' 4' ' ' ARG . 2.6 p-10 -115.11 -175.47 2.7 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.921 -0.487 . . . . 0.0 110.996 -179.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.453 ' CG ' ' HA ' ' A' ' 3' ' ' VAL . 5.0 m-20 -66.35 -26.39 67.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.915 -172.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -70.05 -15.57 63.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.292 0.568 . . . . 0.0 110.277 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -87.17 -0.27 85.3 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.222 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.87 -25.78 63.64 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -56.95 -25.83 58.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.7 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.3 m -70.3 141.85 52.3 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.949 0.404 . . . . 0.0 110.486 177.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -59.06 -33.34 70.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.221 0.534 . . . . 0.0 110.971 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -85.96 20.86 2.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.31 -173.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.452 ' HA ' HG22 ' A' ' 22' ' ' THR . . . -70.21 138.65 51.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.787 0.327 . . . . 0.0 111.144 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.482 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -94.53 64.86 3.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.384 -175.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -117.17 122.87 30.65 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.992 174.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.14 127.66 24.91 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 122.864 2.376 . . . . 0.0 112.532 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.556 ' CG2' ' HA ' ' A' ' 104' ' ' LYS . 11.6 pt -123.9 141.61 43.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.053 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -102.57 87.83 3.09 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.402 HG23 ' HB1' ' A' ' 103' ' ' ALA . 16.0 t -108.41 130.07 61.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.838 -173.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 t70 64.87 26.39 12.87 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.777 0.673 . . . . 0.0 110.159 175.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 77.69 14.36 82.49 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.147 -178.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.9 mttp -125.46 148.71 48.73 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -176.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 35.9 m -93.16 126.46 38.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.702 0.287 . . . . 0.0 111.193 -178.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.438 ' HB2' HG13 ' A' ' 37' ' ' ILE . 35.4 m95 -125.59 133.55 24.99 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.322 178.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 11.9 Cg_exo -71.08 -29.95 16.98 Favored 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 122.763 2.309 . . . . 0.0 112.433 178.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.482 HG22 ' HA ' ' A' ' 34' ' ' ALA . 4.8 p -145.92 169.63 18.22 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.326 -177.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 m -69.42 -44.99 70.24 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.4 0.437 . . . . 0.0 111.971 -173.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.418 ' CD ' ' HG1' ' A' ' 46' ' ' THR . 0.4 OUTLIER -67.35 -15.17 63.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -173.814 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.406 ' O ' HG23 ' A' ' 65' ' ' ILE . 10.5 m80 -63.55 -52.18 62.21 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 174.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -65.96 -37.01 84.9 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.148 0.499 . . . . 0.0 109.931 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.53 -50.11 70.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.424 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -69.84 -37.03 76.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.382 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.616 ' HB3' ' HG3' ' A' ' 62' ' ' ARG . . . -62.83 -54.49 38.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.058 -175.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -73.63 -26.88 60.98 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.804 0.335 . . . . 0.0 110.417 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -56.07 -45.41 79.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.358 172.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -76.09 124.25 27.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.98 176.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.761 ' H ' HD22 ' A' ' 57' ' ' LEU . 1.0 OUTLIER -81.05 -15.64 55.52 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.775 179.552 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -78.01 126.23 30.52 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.435 ' CD ' HH21 ' A' ' 62' ' ' ARG . 10.7 tp10 -67.22 -38.17 84.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.504 -173.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.402 ' O ' ' HB3' ' A' ' 63' ' ' GLU . 41.7 mttm -83.41 -25.4 31.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -175.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.526 ' OH ' ' HE3' ' A' ' 83' ' ' LYS . 0.3 OUTLIER -80.82 -23.28 39.32 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.355 -0.938 . . . . 0.0 109.918 173.785 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.616 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 24.9 ttp180 -68.98 -35.58 76.89 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 167.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.402 ' HB3' ' O ' ' A' ' 60' ' ' LYS . 42.1 tt0 -64.83 -36.24 83.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.037 174.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.423 ' CD ' HH21 ' A' ' 67' ' ' ARG . 5.9 tp10 -58.93 -42.89 90.83 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.434 173.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.434 HD11 ' HE1' ' A' ' 77' ' ' MET . 45.6 mm -60.35 -37.13 73.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.979 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -72.15 -32.11 66.59 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.028 0.442 . . . . 0.0 110.415 175.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.423 HH21 ' CD ' ' A' ' 64' ' ' GLU . 35.1 ttp180 -70.57 -26.5 63.56 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.177 -175.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.2 m -87.49 121.97 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 121.485 0.66 . . . . 0.0 110.987 178.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.0 p -83.33 -13.42 55.12 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 173.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.9 m -85.89 117.48 68.8 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.455 -176.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.64 -46.62 0.82 Allowed 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 123.056 2.504 . . . . 0.0 111.954 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.9 tpt -62.51 -33.07 74.15 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.295 -176.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 93.9 t -69.29 -43.36 81.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.199 178.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.71 -38.74 92.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.619 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.99 -45.97 86.64 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.864 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 76' ' ' ARG . 42.4 mtm180 -62.59 -48.22 80.37 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.634 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.749 ' HA ' ' HB2' ' A' ' 80' ' ' ASP . 26.6 ptt? -75.47 -11.06 59.96 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.458 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.32 -32.01 65.56 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.284 -0.726 . . . . 0.0 111.284 169.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -96.64 11.13 36.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.613 0.244 . . . . 0.0 110.918 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.749 ' HB2' ' HA ' ' A' ' 77' ' ' MET . 28.1 t70 -67.2 -19.54 65.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.738 -175.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 74.29 -41.29 0.47 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.653 0.781 . . . . 0.0 111.966 177.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.8 m -83.06 33.15 0.44 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.183 0.516 . . . . 0.0 111.176 -178.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.526 ' HE3' ' OH ' ' A' ' 61' ' ' TYR . 47.4 mmtm -123.32 158.78 57.38 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.698 -178.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.18 103.04 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.603 2.202 . . . . 0.0 112.754 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 83' ' ' LYS . 73.7 mt -105.55 154.49 20.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.978 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.55 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 52.7 mtt180 -99.03 136.27 39.24 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.88 0.371 . . . . 0.0 110.866 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -60.95 -33.7 73.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.855 175.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -95.91 11.45 33.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.99 -176.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.552 ' O ' ' HB2' ' A' ' 93' ' ' LYS . 61.8 t-105 -63.92 -33.58 76.04 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.479 -174.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.82 -23.52 66.7 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.921 0.391 . . . . 0.0 110.681 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.7 m -91.87 -46.05 8.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.235 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.78 2.36 5.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.662 0.268 . . . . 0.0 111.705 -175.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.552 ' HB2' ' O ' ' A' ' 89' ' ' TRP . 35.1 ttmt -55.75 -53.64 54.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.597 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -62.46 -35.0 77.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.089 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -66.63 -51.59 54.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.696 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.2 t -64.31 -40.57 89.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.29 178.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.849 ' HA ' ' HE2' ' A' ' 97' ' ' MET . 2.1 tpt -59.29 -48.85 80.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.677 178.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 44.5 ttp180 -62.48 -35.85 80.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.321 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -64.04 -45.57 88.26 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.153 0.501 . . . . 0.0 110.248 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.52 -42.98 95.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.549 177.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 97' ' ' MET . 92.8 mt -62.05 -36.16 80.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.156 178.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.512 ' HG3' HD11 ' A' ' 152' ' ' LEU . 59.2 ttp85 -62.63 -49.17 76.23 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.186 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.485 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -66.83 -29.75 69.76 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.185 0.517 . . . . 0.0 110.236 -178.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.556 ' HA ' ' CG2' ' A' ' 37' ' ' ILE . 57.5 tttp -59.91 -59.18 5.83 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.296 177.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.499 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 90.2 m-85 -80.07 -40.54 27.43 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.521 ' HA ' ' HD3' ' A' ' 112' ' ' ARG . 2.4 tm-20 -69.73 -37.99 76.69 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 121.154 -0.219 . . . . 0.0 111.385 -173.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.1 tp-100 -65.05 -35.74 82.14 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.045 0.45 . . . . 0.0 110.552 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -108.83 101.45 10.56 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.91 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -53.25 -34.42 57.08 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 112.077 -175.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.78 -44.91 86.56 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.068 177.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 68.1 mt -73.73 -38.87 64.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.525 -177.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.71 ' HG3' HD11 ' A' ' 156' ' ' LEU . 41.9 ttp180 -62.15 -47.98 82.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.531 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.81 -34.67 77.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.023 0.44 . . . . 0.0 110.391 178.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 50.5 tp -63.29 -41.62 98.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.15 177.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 32.2 tp -63.49 -49.25 74.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.304 178.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.98 -19.16 65.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.556 -178.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.29 11.21 12.68 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.5 0.555 . . . . 0.0 112.5 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 75.7 p -101.41 -25.39 13.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.887 0.375 . . . . 0.0 110.762 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.456 ' HB3' ' HD2' ' A' ' 153' ' ' ARG . . . -51.33 137.99 28.91 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.691 -178.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -99.41 31.25 11.35 Favored 'Cis proline' 0 N--CA 1.458 -0.567 0 C-N-CA 124.276 -1.135 . . . . 0.0 113.306 -0.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.23 154.44 38.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.764 0.316 . . . . 0.0 111.274 -178.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.607 ' HD2' HG13 ' A' ' 16' ' ' ILE . 61.4 mttp -80.01 134.55 36.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.075 179.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.441 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 80.8 mt -102.97 113.69 27.37 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.125 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.508 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 26.6 t -131.95 116.25 29.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.503 -178.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -78.87 111.99 15.58 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 174.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.609 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 86.4 t60 -91.61 77.27 5.68 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -177.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.419 ' O ' HG22 ' A' ' 127' ' ' THR . 10.4 t -83.63 92.08 7.59 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 122.328 1.061 . . . . 0.0 109.106 177.147 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -79.96 59.22 3.14 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.189 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -144.48 -51.55 0.29 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.584 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -153.67 128.91 9.75 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.184 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.524 ' HB3' ' HA2' ' A' ' 141' ' ' GLY . . . -76.76 105.47 7.84 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.068 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -151.03 -46.14 0.12 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 120.642 -0.423 . . . . 0.0 112.128 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.689 ' HB3' HD21 ' A' ' 145' ' ' LEU . 7.8 m95 -126.54 35.19 4.68 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -176.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -172.31 -123.1 0.69 Allowed Glycine 0 CA--C 1.506 -0.519 0 C-N-CA 119.237 -1.459 . . . . 0.0 112.87 -177.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.505 ' HB2' ' HA2' ' A' ' 139' ' ' GLY . 1.5 p-10 -107.13 -17.11 14.25 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.308 0.575 . . . . 0.0 109.576 176.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.405 ' HA3' ' CB ' ' A' ' 131' ' ' ALA . . . 64.6 18.94 64.32 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.773 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.609 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 86.11 10.89 74.01 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.042 -0.599 . . . . 0.0 113.303 -179.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -163.72 23.08 0.08 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 117.453 0.627 . . . . 0.0 112.206 -178.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . 0.505 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 81.65 -49.82 4.13 Favored Glycine 0 CA--C 1.524 0.611 0 C-N-CA 120.86 -0.686 . . . . 0.0 113.703 176.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -81.14 60.24 4.2 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.642 0.734 . . . . 0.0 110.275 -175.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.524 ' HA2' ' HB3' ' A' ' 131' ' ' ALA . . . -125.31 15.41 7.25 Favored Glycine 0 C--N 1.317 -0.499 0 CA-C-N 115.277 -0.874 . . . . 0.0 113.495 -179.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 67.1 mttm 70.44 79.47 0.18 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.547 0.689 . . . . 0.0 111.006 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.81 5.34 2.61 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.084 -177.504 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.471 ' NE ' ' HA ' ' A' ' 144' ' ' ARG . 3.7 mmp_? -54.61 -29.96 53.32 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.689 HD21 ' HB3' ' A' ' 133' ' ' TRP . 54.2 tp -61.18 -49.91 75.29 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.051 0.453 . . . . 0.0 110.463 177.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.603 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -61.23 -32.51 80.9 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.973 177.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -72.9 -36.81 67.38 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.594 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.6 mt -59.43 -37.23 77.55 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.57 -39.89 94.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.663 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.603 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 52.9 mtt -64.73 -50.5 66.65 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.096 0.474 . . . . 0.0 110.275 177.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -60.42 -43.2 96.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.933 -178.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.512 HD11 ' HG3' ' A' ' 102' ' ' ARG . 44.8 tp -65.24 -40.84 94.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.462 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.456 ' HD2' ' HB3' ' A' ' 119' ' ' ALA . 51.6 ttp85 -56.69 -44.67 81.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.771 178.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.492 ' O ' HG13 ' A' ' 158' ' ' ILE . 26.2 tt0 -71.78 -36.05 70.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.521 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 58.3 tp60 -61.66 -43.12 99.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.089 0.471 . . . . 0.0 110.292 176.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.71 HD11 ' HG3' ' A' ' 112' ' ' ARG . 93.1 mt -71.56 -29.83 65.18 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.55 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.406 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -63.42 -38.67 92.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.375 176.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 154' ' ' GLU . 75.1 mt -57.97 -43.26 84.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.56 176.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -61.44 -40.21 93.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.169 177.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -71.87 -23.25 61.48 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.749 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 157' ' ' ALA . 5.0 mp -79.09 -40.54 30.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.191 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.749 ' HB2' ' HD2' ' A' ' 164' ' ' HIS . 44.5 mt-10 -84.95 -18.51 34.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.089 0.471 . . . . 0.0 110.631 177.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 64.29 14.91 9.07 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.227 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . 0.749 ' HD2' ' HB2' ' A' ' 162' ' ' GLU . 18.3 p80 -73.39 126.83 31.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.044 0.449 . . . . 0.0 110.315 -177.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -97.67 158.25 15.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.566 -177.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -152.41 163.78 38.83 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.935 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -89.81 -38.65 13.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.681 0.277 . . . . 0.0 111.3 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.76 -179.604 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.4 ' HG3' ' O ' ' A' ' 1' ' ' MET . 22.6 ptt? . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 121.072 0.463 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -72.13 -34.67 7.87 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.877 2.385 . . . . 0.0 111.668 175.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -137.11 136.05 47.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.374 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -87.24 89.63 8.06 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.403 ' O ' HD13 ' A' ' 114' ' ' LEU . . . -92.43 -67.26 0.87 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.078 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.82 108.39 3.93 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -177.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -140.68 -6.7 1.13 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.917 179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 48.7 mm -108.99 99.58 8.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.236 0.541 . . . . 0.0 110.632 -175.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -81.97 -35.46 28.97 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.571 177.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -172.73 120.94 0.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.078 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.508 HG23 ' HD2' ' A' ' 120' ' ' PRO . 5.7 m -72.0 135.43 27.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.051 0.453 . . . . 0.0 110.636 175.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.423 ' HE2' HG23 ' A' ' 15' ' ' THR . 0.0 OUTLIER -79.59 14.06 1.8 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.83 -176.971 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 69.77 159.54 0.19 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.468 0.707 . . . . 0.0 111.053 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 51.03 29.72 4.8 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.382 0.611 . . . . 0.0 110.99 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.423 HG23 ' HE2' ' A' ' 12' ' ' MET . 20.4 m -86.87 124.28 32.92 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.281 -174.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 56.3 mt -110.66 115.48 49.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 169.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.2 mt -89.81 106.16 16.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.233 0.539 . . . . 0.0 110.286 -176.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.585 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 8.0 t-20 -106.65 126.86 52.82 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.591 -177.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.438 ' O ' ' HG3' ' A' ' 125' ' ' GLU . 27.2 p90 -128.78 -175.15 3.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.912 -178.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.416 ' C ' ' HG ' ' A' ' 21' ' ' SER . 1.0 OUTLIER -142.19 104.72 4.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.11 -177.261 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.416 ' HG ' ' C ' ' A' ' 20' ' ' TYR . 79.7 p 53.92 -166.33 0.08 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.622 0.769 . . . . 0.0 112.207 175.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.706 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 0.2 OUTLIER -81.71 -59.45 2.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.998 0.428 . . . . 0.0 110.232 178.66 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t 59.26 -96.34 0.06 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.444 175.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -144.24 -67.91 0.33 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.016 0.436 . . . . 0.0 111.732 -175.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -81.05 -79.4 0.16 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -165.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -88.92 -1.76 58.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.192 0.52 . . . . 0.0 111.532 -171.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.706 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -66.82 -0.63 9.1 Favored Glycine 0 CA--C 1.52 0.387 0 CA-C-N 116.019 -0.537 . . . . 0.0 114.231 -175.199 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.566 ' CG ' ' HZ3' ' A' ' 104' ' ' LYS . 23.4 t70 -50.68 -32.1 18.31 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 117.332 0.566 . . . . 0.0 111.96 178.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -72.58 -12.54 61.1 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 98.6 p -77.3 126.89 31.65 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.843 177.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -51.15 -23.18 3.03 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -175.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.48 ' CZ ' ' HB2' ' A' ' 71' ' ' PRO . 54.1 t80 -62.4 -62.38 1.79 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 174.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.551 ' HA ' HG23 ' A' ' 22' ' ' THR . . . 32.26 -149.7 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.272 1.029 . . . . 0.0 113.753 -176.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -166.24 66.2 0.11 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.407 177.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.489 ' O ' ' HA ' ' A' ' 46' ' ' THR . 94.6 m95 -131.1 121.65 18.83 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.629 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.485 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 19.2 Cg_endo -59.4 126.55 21.08 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.854 2.37 . . . . 0.0 112.515 178.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.2 pt -119.86 157.74 22.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.155 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -119.42 95.34 4.75 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -177.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 t -131.09 142.31 43.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.174 -0.467 . . . . 0.0 109.971 -176.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.8 t70 67.14 17.06 10.35 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.817 0.818 . . . . 0.0 109.58 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 72.19 22.23 78.94 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.353 -174.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.3 tppt? -121.82 149.92 42.64 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -176.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.7 m -94.95 113.51 25.23 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.872 0.368 . . . . 0.0 110.156 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.485 ' O ' ' HA ' ' A' ' 36' ' ' PRO . 41.6 m95 -109.89 123.47 36.17 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.436 ' O ' ' HB ' ' A' ' 46' ' ' THR . 39.8 Cg_exo -58.94 -11.9 13.65 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 123.053 2.502 . . . . 0.0 113.794 -177.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.489 ' HA ' ' O ' ' A' ' 35' ' ' TRP . 8.9 t 177.57 170.11 0.63 Allowed 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 174.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -40.59 88.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -175.172 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -48.17 -42.57 30.08 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.195 0.31 . . . . 0.0 111.785 176.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -64.64 -41.86 95.85 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.181 -176.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -69.95 -43.52 71.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.215 0.531 . . . . 0.0 110.179 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.433 ' HA ' HG11 ' A' ' 96' ' ' VAL . 89.5 t80 -61.26 -42.36 98.5 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.497 178.301 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.637 ' HG3' HD12 ' A' ' 65' ' ' ILE . 5.3 tp-100 -68.83 -45.56 70.84 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.885 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.467 ' HB1' ' CG ' ' A' ' 62' ' ' ARG . . . -65.9 -47.43 74.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.762 -177.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -75.23 -13.69 60.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.569 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.722 ' HZ1' ' HB2' ' A' ' 55' ' ' LYS . 4.9 ttmp? -59.23 -33.19 70.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.077 0.465 . . . . 0.0 110.532 171.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.544 ' CE1' ' HG3' ' A' ' 83' ' ' LYS . 56.9 m-85 -107.32 166.99 10.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.971 -176.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.677 ' H ' HD22 ' A' ' 57' ' ' LEU . 2.5 pt? -115.08 11.37 16.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.043 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -97.15 123.22 40.85 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.225 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.15 -40.13 86.64 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.101 -173.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -60.21 -53.77 53.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.923 0.392 . . . . 0.0 110.348 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.486 ' O ' HG13 ' A' ' 65' ' ' ILE . 3.1 t80 -66.44 -32.81 74.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.592 -177.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.467 ' CG ' ' HB1' ' A' ' 53' ' ' ALA . 44.4 ttm-85 -60.6 -49.41 77.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.019 0.437 . . . . 0.0 110.313 178.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -78.4 -15.15 58.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.109 0.48 . . . . 0.0 110.354 -178.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -74.66 -40.31 61.51 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.637 HD12 ' HG3' ' A' ' 52' ' ' GLN . 72.0 mt -70.39 -25.81 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.124 174.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.07 -22.06 53.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.854 174.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 73.4 ttt-85 -80.99 -29.97 35.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.958 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.492 HG22 ' HB ' ' A' ' 73' ' ' VAL . 14.9 p -75.8 126.61 36.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.235 0.54 . . . . 0.0 110.736 -179.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m -74.44 -41.75 60.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.506 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 30.2 t -69.09 130.05 91.63 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.069 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.48 ' HB2' ' CZ ' ' A' ' 32' ' ' PHE . 7.2 Cg_exo -73.45 -26.07 14.6 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.592 2.194 . . . . 0.0 111.322 174.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.5 tpt -70.44 -43.27 70.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.321 -177.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.492 ' HB ' HG22 ' A' ' 68' ' ' VAL . 59.8 t -63.84 -34.09 66.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.048 177.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.14 -49.53 74.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.472 177.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.478 ' HA ' HE21 ' A' ' 52' ' ' GLN . . . -60.16 -37.42 80.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.551 177.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -62.08 -33.93 75.34 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.758 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.503 ' SD ' HG12 ' A' ' 65' ' ' ILE . 56.1 mtt -65.72 -50.69 63.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.131 0.491 . . . . 0.0 111.473 -179.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.599 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -94.3 4.42 70.32 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.29 -0.957 . . . . 0.0 113.568 -174.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 5.3 tpp180 -71.24 -25.13 62.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.908 0.354 . . . . 0.0 111.211 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -99.37 131.97 45.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.152 0.501 . . . . 0.0 109.701 177.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.429 ' C ' ' H ' ' A' ' 83' ' ' LYS . 44.5 mtm180 -101.35 29.88 4.52 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.397 -172.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.4 p -82.7 19.73 1.27 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.574 0.702 . . . . 0.0 109.935 174.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.544 ' HG3' ' CE1' ' A' ' 56' ' ' PHE . 41.1 mmtm -89.22 169.72 12.36 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.703 178.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.523 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 16.8 Cg_endo -60.14 -29.13 88.42 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.332 2.021 . . . . 0.0 111.537 170.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.7 mt 67.72 -174.06 0.19 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.129 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.447 ' HB3' ' HB2' ' A' ' 89' ' ' TRP . 57.0 ttt-85 -134.18 142.27 47.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.811 -176.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -64.37 -68.41 0.36 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.799 -175.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -81.96 25.94 0.54 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.411 -174.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.491 ' CZ2' ' HE3' ' A' ' 55' ' ' LYS . 58.5 t-105 -61.0 -33.11 72.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.117 0.484 . . . . 0.0 110.104 177.294 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.412 ' O ' ' HE3' ' A' ' 93' ' ' LYS . 40.3 tt0 -55.92 -35.78 66.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.071 -178.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.1 p -99.93 -8.52 23.88 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -173.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.483 HG23 ' HA ' ' A' ' 89' ' ' TRP . 33.7 m -108.74 1.81 9.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -175.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.663 ' HB2' ' HZ2' ' A' ' 93' ' ' LYS . 10.0 mtmp? -54.92 -57.69 10.63 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.593 0.711 . . . . 0.0 110.49 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.472 ' CD ' ' H ' ' A' ' 94' ' ' GLU . 1.9 pm0 -78.14 -14.94 59.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.134 -178.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.534 ' O ' ' HD3' ' A' ' 99' ' ' LYS . 34.0 tt0 -73.11 -52.37 14.5 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 176.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.433 HG11 ' HA ' ' A' ' 51' ' ' PHE . 96.8 t -58.44 -41.41 81.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.996 177.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.402 ' HE1' ' CG ' ' A' ' 51' ' ' PHE . 16.6 mmt -60.46 -39.0 86.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.281 176.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 38.1 ttm-85 -61.56 -38.45 87.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.524 0.202 . . . . 0.0 111.105 -178.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.534 ' HD3' ' O ' ' A' ' 95' ' ' GLN . 0.3 OUTLIER -71.03 -48.17 54.46 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.916 0.388 . . . . 0.0 110.805 176.23 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.2 -42.86 99.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.466 -177.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.6 -38.56 84.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.182 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 52.1 ttt180 -63.3 -48.17 79.2 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.06 178.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.02 -38.01 78.26 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.981 0.419 . . . . 0.0 110.408 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.566 ' HZ3' ' CG ' ' A' ' 28' ' ' ASP . 60.4 tttm -62.11 -52.37 64.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.323 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 68.5 m-85 -81.96 -41.66 20.49 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -174.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -75.42 -39.59 58.76 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 121.969 -0.457 . . . . 0.0 111.197 -173.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -74.63 -31.19 61.91 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.796 0.331 . . . . 0.0 110.662 -178.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -100.21 97.55 8.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.31 66.04 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -171.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -68.14 -32.45 72.74 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.038 -178.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.502 HD11 ' HZ1' ' A' ' 104' ' ' LYS . 42.4 mt -74.34 -37.15 63.61 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.546 ' HG3' HD13 ' A' ' 156' ' ' LEU . 24.5 ttm180 -58.23 -50.26 74.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.121 177.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.95 -39.88 95.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.724 -179.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 5' ' ' ALA . 58.6 tp -59.46 -48.83 80.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.583 177.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 44.1 tp -62.93 -39.61 95.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.993 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.402 HD21 ' HB2' ' A' ' 156' ' ' LEU . 80.5 mt -76.61 -15.03 59.94 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -82.97 -18.18 40.84 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.71 0.291 . . . . 0.0 111.159 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 66.2 p -72.44 -35.01 68.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.031 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.66 138.47 16.87 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.793 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . 0.508 ' HD2' HG23 ' A' ' 11' ' ' VAL . 43.1 Cg_endo -95.72 29.16 15.96 Favored 'Cis proline' 0 CA--C 1.533 0.458 0 C-N-CA 124.147 -1.189 . . . . 0.0 113.657 1.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.19 153.32 43.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.88 0.372 . . . . 0.0 111.354 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -92.29 134.81 34.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.261 -177.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 40.1 mt -98.5 109.45 22.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.88 0.372 . . . . 0.0 110.708 -177.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.585 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 91.2 t -139.41 122.72 18.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.447 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 19' ' ' PHE . 87.6 tt0 -101.31 118.19 36.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.088 0.47 . . . . 0.0 110.77 176.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.766 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 57.4 t60 -89.92 81.76 6.25 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 173.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 14.5 t -120.86 143.52 48.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.304 -178.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -118.56 9.03 12.14 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.403 0.62 . . . . 0.0 109.808 175.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -62.24 -33.33 74.38 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.468 176.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -155.52 119.0 4.41 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.449 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -80.73 85.51 6.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.225 0.536 . . . . 0.0 110.787 -175.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.697 ' HA ' ' O ' ' A' ' 141' ' ' GLY . 40.2 t80 179.01 153.03 0.38 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.559 -1.2 . . . . 0.0 107.911 173.144 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.628 ' O ' ' HB3' ' A' ' 145' ' ' LEU . 84.1 m95 78.73 -19.19 0.46 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.557 0.743 . . . . 0.0 111.537 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.443 ' HA2' ' HA ' ' A' ' 143' ' ' ASN . . . -138.04 -152.82 6.12 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.373 -174.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.766 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 20.4 t70 -67.46 -24.86 65.65 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.156 0.503 . . . . 0.0 110.802 178.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.514 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 72.51 8.32 71.09 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.506 178.357 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 88.17 -10.66 70.13 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.408 -0.425 . . . . 0.0 113.103 178.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . 0.587 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 24.9 p80 -160.63 30.12 0.16 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.928 0.364 . . . . 0.0 111.625 -173.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 84.35 -51.37 4.55 Favored Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.813 -0.708 . . . . 0.0 113.191 177.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.587 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 53.1 mttp -75.49 55.4 0.81 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.073 0.463 . . . . 0.0 111.676 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.697 ' O ' ' HA ' ' A' ' 132' ' ' TYR . . . -123.7 -4.84 7.91 Favored Glycine 0 C--O 1.223 -0.576 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.0 176.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.433 ' C ' ' H ' ' A' ' 144' ' ' ARG . 2.9 mptp? 61.4 84.2 0.14 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.962 0.381 . . . . 0.0 111.722 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.443 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 8.0 t30 -68.08 5.73 0.87 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.412 1.085 . . . . 0.0 111.597 -178.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.433 ' H ' ' C ' ' A' ' 142' ' ' LYS . 14.0 tpt180 -33.06 -31.05 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.542 1.137 . . . . 0.0 113.276 176.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.628 ' HB3' ' O ' ' A' ' 133' ' ' TRP . 25.5 tp -68.23 -49.23 62.12 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 117.944 0.338 . . . . 0.0 110.957 -179.268 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -61.47 -32.54 81.51 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.251 -0.74 . . . . 0.0 111.251 177.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -69.01 -43.25 75.17 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 175.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.5 -48.79 76.44 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.439 175.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.82 -42.08 88.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.892 178.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 73.1 mtm -69.04 -37.46 78.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.331 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -60.57 -51.63 68.59 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.705 0.288 . . . . 0.0 110.253 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.456 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 64.3 tp -60.11 -43.07 95.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.416 178.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.403 ' NH1' ' HG3' ' A' ' 154' ' ' GLU . 2.4 ttt-85 -51.85 -56.95 10.92 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.676 177.352 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.478 ' O ' HG13 ' A' ' 158' ' ' ILE . 35.8 mt-10 -72.86 -22.98 60.69 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.213 -178.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -68.57 -39.14 81.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.222 174.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.546 HD13 ' HG3' ' A' ' 112' ' ' ARG . 96.0 mt -67.93 -31.25 70.87 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.108 0.48 . . . . 0.0 109.892 179.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.538 ' O ' HD11 ' A' ' 161' ' ' LEU . . . -67.38 -46.08 74.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.34 175.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 154' ' ' GLU . 85.2 mt -65.72 -34.39 70.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -59.67 -34.35 72.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.303 0.573 . . . . 0.0 109.943 175.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.745 ' HA ' ' HD2' ' A' ' 163' ' ' HIS . 26.9 ttpp -79.14 -18.81 52.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.667 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . 0.538 HD11 ' O ' ' A' ' 157' ' ' ALA . 6.1 mp -78.43 -25.06 45.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.114 0.483 . . . . 0.0 110.619 176.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -84.07 11.26 8.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.324 178.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.745 ' HD2' ' HA ' ' A' ' 160' ' ' LYS . 3.5 m-70 -61.49 93.68 0.04 OUTLIER 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 173.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . 0.412 ' C ' ' H ' ' A' ' 166' ' ' HIS . 22.0 t60 -103.69 41.21 1.31 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.223 0.535 . . . . 0.0 110.217 -174.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 49.3 t-80 -77.91 14.93 0.97 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.666 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.44 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 11.9 m170 68.35 -172.16 0.19 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.317 0.579 . . . . 0.0 110.888 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -145.19 103.88 3.9 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.123 173.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 . . . . . 0 C--O 1.245 0.856 0 CA-C-O 118.343 -0.837 . . . . 0.0 109.586 -173.635 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.4 t . . . . . 0 N--CA 1.455 -0.201 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -131.12 153.83 48.96 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.657 -176.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.51 136.15 42.2 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 163.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.7 mm-40 . . . . . 0 N--CA 1.466 0.338 0 O-C-N 123.656 0.597 . . . . 0.0 110.538 -173.757 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.6 t60 . . . . . 0 CA--C 1.528 0.123 0 CA-C-O 120.77 0.319 . . . . 0.0 110.432 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -61.53 168.85 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 111.09 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.456 ' O ' ' HB2' ' A' ' 13' ' ' GLN . 4.5 mtt -64.09 -85.5 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.215 -174.014 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' MET . 51.8 tt0 169.89 120.49 0.01 OUTLIER 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.759 -177.052 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 65.03 26.16 12.62 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.24 0.543 . . . . 0.0 110.509 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.47 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 29.3 m -76.87 110.97 11.92 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.299 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.9 mm -77.35 108.36 10.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.9 mt -95.82 99.32 9.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.764 -177.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -90.75 106.67 18.67 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 173.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -117.47 132.8 56.49 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.036 -175.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -150.48 100.36 2.86 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.773 167.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.409 ' HB3' ' OD2' ' A' ' 24' ' ' ASP . 6.9 m 177.89 88.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 O-C-N 124.065 0.853 . . . . 0.0 109.458 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.701 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 1.3 m -79.87 2.63 22.55 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.994 0.426 . . . . 0.0 111.473 -174.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.1 m -91.42 -8.32 48.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.706 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.409 ' OD2' ' HB3' ' A' ' 21' ' ' SER . 4.1 p30 -131.18 -165.5 1.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.305 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -65.7 -26.46 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.364 -172.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -80.38 -2.49 45.75 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.92 0.39 . . . . 0.0 111.034 177.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.701 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -83.26 -16.84 68.19 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.728 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -68.25 -26.64 65.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.071 0.462 . . . . 0.0 110.898 -179.047 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -69.28 -26.17 64.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.31 178.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.3 m -76.08 126.76 31.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 171.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -60.46 -20.71 60.85 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -76.51 4.71 8.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.116 0.484 . . . . 0.0 111.225 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -66.75 131.46 46.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.749 0.309 . . . . 0.0 110.678 176.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.499 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -80.93 58.83 3.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.198 0.523 . . . . 0.0 111.681 -175.044 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -102.34 117.64 60.66 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.822 174.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.6 125.14 17.8 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.956 2.438 . . . . 0.0 112.556 -176.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.757 HG22 ' HA ' ' A' ' 104' ' ' LYS . 29.5 pt -114.4 139.34 40.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.299 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -102.54 105.09 15.55 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.441 HG22 ' CB ' ' A' ' 103' ' ' ALA . 4.0 t -128.57 123.12 58.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.263 -173.766 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 59.21 27.21 16.16 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.191 174.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.61 -5.62 57.01 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.563 -0.827 . . . . 0.0 113.433 175.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.519 ' HD3' ' HD2' ' A' ' 66' ' ' ARG . 60.9 mttm -124.05 156.9 35.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 117.596 0.698 . . . . 0.0 111.373 -178.468 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.1 m -100.54 117.04 33.88 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.266 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.489 ' HB2' HG13 ' A' ' 37' ' ' ILE . 41.1 m95 -105.86 133.92 19.98 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.431 -179.118 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 43.8 Cg_exo -58.43 -41.27 67.17 Favored 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 122.66 2.24 . . . . 0.0 112.752 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.499 HG22 ' HA ' ' A' ' 34' ' ' ALA . 77.9 p -148.24 172.14 14.82 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -33.49 75.18 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -177.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.592 ' H ' ' CD ' ' A' ' 48' ' ' GLU . 3.6 mp0 -61.3 -28.55 69.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.947 0.403 . . . . 0.0 110.904 -177.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.419 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 57.1 m80 -65.91 -48.01 72.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.401 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -72.75 -35.99 67.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.335 0.588 . . . . 0.0 109.758 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -59.58 -49.1 79.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.028 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.434 ' HA ' ' CB ' ' A' ' 55' ' ' LYS . 37.2 mt-30 -85.97 -13.31 48.02 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.682 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.479 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -69.43 -30.43 68.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.26 0.552 . . . . 0.0 109.961 173.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -90.8 -21.76 21.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.649 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.434 ' CB ' ' HA ' ' A' ' 52' ' ' GLN . 83.0 tttt -58.12 -53.31 59.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.2 0.524 . . . . 0.0 110.606 176.246 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -91.56 142.05 28.05 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.75 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.759 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.4 pt? -98.5 10.13 41.62 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 173.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.4 ' HB2' ' HB3' ' A' ' 61' ' ' TYR . 33.7 m-20 -67.51 112.34 4.63 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.762 174.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -50.98 -61.82 1.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.022 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -77.16 -18.27 57.96 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.866 -171.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.543 ' O ' HG13 ' A' ' 65' ' ' ILE . 3.9 t80 -80.58 -35.64 33.95 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.479 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 33.5 ttm180 -59.21 -44.44 92.26 Favored 'General case' 0 CA--C 1.521 -0.144 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 173.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.42 -39.72 76.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.495 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.441 ' CD ' HH21 ' A' ' 67' ' ' ARG . 7.8 tp10 -63.0 -49.24 75.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.916 0.389 . . . . 0.0 110.682 177.443 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.543 HG13 ' O ' ' A' ' 61' ' ' TYR . 3.5 mt -70.19 -22.78 24.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.185 0.517 . . . . 0.0 110.877 -177.559 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.519 ' HD2' ' HD3' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -78.46 -29.27 46.77 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.211 176.891 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.441 HH21 ' CD ' ' A' ' 64' ' ' GLU . 56.5 ttp180 -86.02 -35.44 20.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.638 -175.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.4 p -65.43 117.4 6.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.474 0.654 . . . . 0.0 111.22 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.2 m -77.14 -33.72 56.66 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.593 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.3 m -66.24 126.55 92.2 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.335 -178.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.419 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 54.4 Cg_endo -71.86 -40.64 2.56 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.828 2.352 . . . . 0.0 113.281 -179.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 87.0 mtp -70.29 -29.8 66.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.745 0.307 . . . . 0.0 110.74 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.519 ' O ' ' HG3' ' A' ' 77' ' ' MET . 99.6 t -66.74 -39.51 83.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.558 178.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.36 -39.36 90.33 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 120.92 0.391 . . . . 0.0 110.369 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.64 -38.27 80.34 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.711 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -65.97 -57.36 8.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.954 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -83.26 -13.04 56.08 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.319 -0.553 . . . . 0.0 111.159 -176.58 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.34 -10.33 60.87 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.644 -0.788 . . . . 0.0 111.607 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.72 -40.46 66.09 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 122.742 0.417 . . . . 0.0 111.647 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.456 ' OD2' ' HG3' ' A' ' 83' ' ' LYS . 30.3 t70 -59.73 137.47 58.03 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.015 -170.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 87.1 mtm-85 -116.96 18.54 14.67 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.059 176.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.4 m -90.91 -28.96 17.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.663 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.456 ' HG3' ' OD2' ' A' ' 80' ' ' ASP . 6.1 mtpm? -63.31 156.69 68.26 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.257 176.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.05 113.62 1.66 Allowed 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.43 2.087 . . . . 0.0 111.786 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 67.0 mt -101.04 163.75 12.14 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.485 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.443 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 23.6 mtp180 -67.26 139.27 57.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.842 0.353 . . . . 0.0 110.446 176.108 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 43.2 mtpt -60.64 -28.41 68.54 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.495 0.664 . . . . 0.0 110.604 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -104.07 12.96 33.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.413 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.493 ' HA ' HG22 ' A' ' 92' ' ' VAL . 50.3 t-105 -59.98 -33.65 72.24 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.534 -176.182 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.66 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 18.3 mm-40 -65.65 -24.32 67.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.398 -179.143 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.3 t -99.68 -44.78 5.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.299 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.7 m -73.96 3.01 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -170.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.66 ' NZ ' ' HA ' ' A' ' 90' ' ' GLU . 56.7 mttp -56.79 -42.35 79.32 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 175.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.498 ' O ' ' HB2' ' A' ' 98' ' ' ARG . 52.1 mt-10 -61.13 -39.5 90.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.833 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -69.19 -50.88 43.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.368 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 59.6 t -63.78 -49.37 82.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.776 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.498 ' SD ' HD13 ' A' ' 145' ' ' LEU . 50.7 ttm -66.2 -36.06 82.08 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.335 -177.297 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' A' ' 94' ' ' GLU . 20.3 ttt180 -61.31 -43.16 99.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.832 0.349 . . . . 0.0 110.664 -179.617 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -70.51 -35.34 73.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.572 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.88 88.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.732 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.468 HD11 HD12 ' A' ' 145' ' ' LEU . 94.0 mt -64.46 -40.3 95.44 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.53 176.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.497 ' O ' ' HB2' ' A' ' 106' ' ' GLU . 34.2 ttm180 -54.17 -54.46 39.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.1 175.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.441 ' CB ' HG22 ' A' ' 39' ' ' VAL . . . -62.05 -34.43 76.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.457 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.757 ' HA ' HG22 ' A' ' 37' ' ' ILE . 64.4 tttm -63.96 -56.1 17.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.249 -178.57 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.497 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 71.2 m-85 -78.38 -28.0 46.96 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -175.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -79.02 -40.58 31.04 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.09 -177.464 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -69.61 -14.67 62.95 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.05 0.452 . . . . 0.0 110.884 -176.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -124.98 105.97 9.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.359 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -56.67 -31.43 64.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.96 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.05 -47.41 81.03 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.964 177.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 36.0 mt -74.49 -39.85 62.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.763 -175.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.589 ' HG3' HD13 ' A' ' 156' ' ' LEU . 61.9 ttt180 -59.12 -48.45 81.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.451 178.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.8 -35.14 80.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.553 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 62.2 tp -64.61 -37.15 86.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.61 176.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.471 ' HG ' ' HB2' ' A' ' 153' ' ' ARG . 16.5 tp -64.02 -50.52 68.14 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.099 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.506 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 4.6 mp -67.44 -19.71 65.4 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.82 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -67.67 -30.15 69.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.511 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.445 ' HB ' HD21 ' A' ' 123' ' ' LEU . 70.0 p -81.3 -0.46 41.06 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 120.758 0.313 . . . . 0.0 111.683 -177.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.541 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -86.33 139.94 34.17 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 170.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.433 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 73.7 Cg_endo -99.11 74.67 0.14 OUTLIER 'Cis proline' 0 N--CA 1.454 -0.799 0 C-N-CA 124.468 -1.055 . . . . 0.0 113.291 -0.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.47 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -111.0 176.4 5.04 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -120.83 120.53 35.83 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.996 0.426 . . . . 0.0 110.272 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.445 HD21 ' HB ' ' A' ' 118' ' ' THR . 9.1 mt -86.32 125.85 33.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.787 -173.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.2 t -130.83 116.85 35.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.845 0.355 . . . . 0.0 110.925 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -79.99 130.48 35.31 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 175.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.633 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 10.6 t60 -125.64 77.47 1.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.188 0.518 . . . . 0.0 109.613 -173.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 5.0 t -87.2 114.23 23.63 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.543 0.687 . . . . 0.0 109.319 175.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.711 ' OE2' ' HA3' ' A' ' 137' ' ' GLY . 5.6 tp10 -82.17 41.32 0.67 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.616 0.722 . . . . 0.0 109.378 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -143.06 -75.79 0.26 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.375 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -118.42 95.35 4.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.068 -174.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.35 86.08 2.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.165 -177.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.448 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 28.7 t80 -151.08 122.06 7.65 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.606 ' O ' ' HB3' ' A' ' 145' ' ' LEU . 71.3 m95 74.73 -10.34 1.2 Allowed 'General case' 0 N--CA 1.474 0.737 0 O-C-N 124.016 0.823 . . . . 0.0 110.585 -171.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.569 ' O ' ' HA3' ' A' ' 141' ' ' GLY . . . -137.79 136.99 8.54 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 108.196 -1.962 . . . . 0.0 108.196 176.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.561 ' HB2' ' HB2' ' A' ' 143' ' ' ASN . 1.4 t70 -68.82 1.77 3.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.697 0.749 . . . . 0.0 112.109 -166.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 68.85 -164.53 49.32 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.933 175.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.711 ' HA3' ' OE2' ' A' ' 128' ' ' GLU . . . -89.98 -17.02 55.13 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.924 178.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -99.63 -16.92 18.05 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 89.08 62.07 1.38 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.118 -1.039 . . . . 0.0 112.468 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 56.4 tttm 176.84 65.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 176.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.569 ' HA3' ' O ' ' A' ' 134' ' ' GLY . . . -124.67 4.62 8.61 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.176 -1.012 . . . . 0.0 113.441 -173.014 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.438 ' C ' ' H ' ' A' ' 144' ' ' ARG . 55.0 mttp 64.19 53.71 1.73 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.122 0.486 . . . . 0.0 109.895 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' ASN . . . . . 0.561 ' HB2' ' HB2' ' A' ' 135' ' ' ASP . 7.4 t30 -57.15 5.1 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.368 1.467 . . . . 0.0 113.791 -177.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.533 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 57.9 mtm180 -51.84 -13.28 0.26 Allowed 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.606 ' HB3' ' O ' ' A' ' 133' ' ' TRP . 25.4 tp -60.57 -49.84 75.94 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 171.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.653 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -62.92 -33.03 85.98 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.555 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -68.82 -41.21 78.93 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 121.165 -0.214 . . . . 0.0 110.638 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 88.7 mt -58.05 -37.13 73.82 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.83 -38.07 89.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.914 175.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.653 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 38.5 mtt -66.35 -50.28 64.08 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.183 0.516 . . . . 0.0 110.189 178.535 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 23.0 tt0 -69.38 -35.95 76.31 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.608 -176.061 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 102' ' ' ARG . 50.9 tp -62.07 -43.92 97.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.041 0.448 . . . . 0.0 109.859 174.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.541 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 47.5 ttp85 -55.51 -41.54 73.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.969 176.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' GLU . . . . . 0.503 ' O ' HG13 ' A' ' 158' ' ' ILE . 31.6 tt0 -68.36 -34.71 76.57 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.684 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' ' 151' ' ' GLU . 15.3 mt-30 -65.35 -41.85 93.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.068 0.461 . . . . 0.0 109.858 176.034 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.589 HD13 ' HG3' ' A' ' 112' ' ' ARG . 94.3 mt -67.27 -28.88 68.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.086 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -69.44 -40.95 76.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.453 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 154' ' ' GLU . 76.2 mt -60.63 -46.06 96.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.669 0.271 . . . . 0.0 110.474 178.02 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 159' ' ' GLU . . . . . 0.49 ' CD ' HH22 ' A' ' 112' ' ' ARG . 0.2 OUTLIER -61.3 -38.45 86.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.07 0.462 . . . . 0.0 110.088 177.381 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -70.33 -33.31 71.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.477 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 4.6 mp -68.63 -10.62 57.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.132 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.426 174.988 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.779 HG22 ' H ' ' A' ' 5' ' ' ALA . 2.5 p . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.501 0.191 . . . . 0.0 110.926 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.68 ' H ' HG13 ' A' ' 3' ' ' VAL . 7.2 tpp85 56.84 25.73 10.73 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.74 0.781 . . . . 0.0 111.586 178.007 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.779 ' H ' HG22 ' A' ' 3' ' ' VAL . . . -69.32 127.87 34.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 173.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 . . . . . 0 C--N 1.324 -0.515 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.946 -176.145 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.1 p80 . . . . . 0 CA--C 1.517 -0.292 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.728 HG21 ' HD2' ' A' ' 120' ' ' PRO . 34.1 m -93.74 175.19 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 174.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 51.4 mtm -108.95 37.22 2.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.312 -178.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.403 ' H ' HG23 ' A' ' 11' ' ' VAL . 52.2 tt0 63.83 102.56 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.952 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.3 t70 49.95 79.84 0.08 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.528 -175.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.8 m -103.66 127.41 51.1 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.713 -178.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 48.5 mt -96.67 107.13 19.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 CA-C-O 121.446 0.641 . . . . 0.0 110.074 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -89.89 96.96 6.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.24 -176.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -83.51 101.34 11.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.362 174.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.447 ' O ' ' HA ' ' A' ' 125' ' ' GLU . 52.5 p90 -116.19 148.93 39.89 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.781 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.44 ' HB2' ' HB3' ' A' ' 126' ' ' HIS . 34.9 t80 -150.23 150.3 31.38 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.388 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 96.1 p 62.48 159.52 0.07 Allowed 'General case' 0 C--O 1.231 0.113 0 O-C-N 124.867 1.354 . . . . 0.0 111.661 177.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.498 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 7.8 p -83.14 -65.99 0.94 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.528 175.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.1 t 61.41 -78.88 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.205 0 O-C-N 124.135 0.897 . . . . 0.0 111.625 176.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -105.9 -169.08 1.53 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.901 0.381 . . . . 0.0 110.117 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -66.02 -31.93 73.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.749 -174.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -75.99 -1.59 26.44 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.309 0.576 . . . . 0.0 111.187 -175.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.498 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -68.53 -0.32 16.93 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.109 174.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -52.36 -32.47 38.55 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.602 0.761 . . . . 0.0 112.642 -177.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -60.1 -36.49 77.53 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.7 t -59.97 148.86 33.74 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.133 0.492 . . . . 0.0 111.04 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -74.5 -14.64 60.84 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.096 0.474 . . . . 0.0 109.928 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -96.84 7.9 45.57 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.31 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.475 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -70.69 136.06 48.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.715 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -83.12 64.6 7.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.608 0.718 . . . . 0.0 110.939 -174.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.414 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 70.4 m95 -108.86 120.97 44.46 Favored Pre-proline 0 C--N 1.314 -0.957 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.048 172.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 34.5 Cg_exo -60.49 133.45 48.97 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.985 2.457 . . . . 0.0 112.518 -177.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.482 HD13 ' HA ' ' A' ' 47' ' ' SER . 39.0 pt -118.81 147.91 22.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.967 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -109.04 98.62 8.06 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.414 ' CG1' ' HE2' ' A' ' 99' ' ' LYS . 21.2 t -122.02 120.37 61.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.913 -174.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 61.57 27.8 17.19 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.593 0.558 . . . . 0.0 110.629 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.39 0.57 90.12 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 121.034 -0.603 . . . . 0.0 112.462 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -104.63 144.4 31.76 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -177.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.1 m -105.29 109.07 20.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.924 0.392 . . . . 0.0 110.674 -175.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.41 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 62.4 m95 -102.05 143.84 27.41 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.713 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 32.4 Cg_exo -59.24 -30.48 93.07 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.939 2.426 . . . . 0.0 112.248 179.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.748 HG23 ' OE1' ' A' ' 48' ' ' GLU . 2.3 t -170.76 -179.93 3.01 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.882 177.441 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.482 ' HA ' HD13 ' A' ' 37' ' ' ILE . 20.3 m -66.62 -39.62 88.41 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 113.369 0.878 . . . . 0.0 113.369 -166.21 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.748 ' OE1' HG23 ' A' ' 46' ' ' THR . 0.6 OUTLIER -63.15 -33.99 76.65 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.498 -171.954 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -56.01 -42.99 77.3 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.609 0.242 . . . . 0.0 111.072 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -71.46 -39.63 70.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.99 0.424 . . . . 0.0 110.24 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -60.63 -38.37 84.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.151 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.1 mm100 -72.87 -46.47 52.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.424 177.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.657 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -61.4 -42.18 98.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.705 -179.232 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -84.8 -13.66 50.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.764 -176.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.591 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.8 ttmp? -64.35 -53.14 53.31 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.86 0.362 . . . . 0.0 110.612 173.202 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.444 ' HE1' ' HB2' ' A' ' 83' ' ' LYS . 92.9 m-85 -80.66 160.22 25.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.12 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.494 HD11 ' HB3' ' A' ' 86' ' ' ARG . 5.5 mp -98.89 -28.84 13.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.645 177.079 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -58.85 120.57 9.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.06 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -68.72 -37.45 79.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -61.27 -42.74 99.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.417 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.423 ' O ' HG13 ' A' ' 65' ' ' ILE . 0.2 OUTLIER -74.14 -37.28 64.09 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.68 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.657 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.5 ttm180 -62.58 -41.56 99.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.397 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.522 ' HG2' ' NH1' ' A' ' 67' ' ' ARG . 16.5 tt0 -71.04 -26.93 63.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.025 178.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -68.09 -40.46 82.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.851 175.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.516 HG12 ' SD ' ' A' ' 77' ' ' MET . 56.6 mt -71.89 -18.52 19.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.283 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -75.38 -24.65 57.27 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.522 ' NH1' ' HG2' ' A' ' 63' ' ' GLU . 35.8 mmt-85 -73.37 -36.08 66.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.999 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.467 HG21 ' HB ' ' A' ' 73' ' ' VAL . 14.9 p -75.39 125.39 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.638 0.733 . . . . 0.0 112.038 -171.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.2 p -91.4 -38.78 12.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.392 176.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 20.0 m -72.57 121.04 83.84 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.513 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -52.52 -46.29 34.23 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.658 2.906 . . . . 0.0 113.519 179.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 85.1 mtp -63.81 -31.36 72.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.322 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.467 ' HB ' HG21 ' A' ' 68' ' ' VAL . 43.2 t -75.98 -32.29 23.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.808 0.337 . . . . 0.0 110.244 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.62 99.51 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.265 0.555 . . . . 0.0 110.462 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.23 -39.51 86.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.09 175.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -34.62 72.03 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.899 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.516 ' SD ' HG12 ' A' ' 65' ' ' ILE . 64.2 mtt -64.73 -55.04 22.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.061 0.458 . . . . 0.0 110.653 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.22 11.59 60.37 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.047 -0.597 . . . . 0.0 113.007 -176.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.54 -15.73 63.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.074 0.464 . . . . 0.0 110.372 174.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -107.18 114.03 27.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.439 177.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.638 ' HB2' HD11 ' A' ' 85' ' ' LEU . 26.1 ptt180 -101.16 24.93 8.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.783 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.4 m -81.08 -9.96 59.74 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.662 0.744 . . . . 0.0 109.223 174.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.444 ' HB2' ' HE1' ' A' ' 56' ' ' PHE . 46.8 mmtm -80.59 166.29 40.5 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.864 177.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -56.31 108.36 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.466 2.111 . . . . 0.0 113.126 -177.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.638 HD11 ' HB2' ' A' ' 81' ' ' ARG . 92.7 mt -91.8 148.85 21.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.824 175.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.494 ' HB3' HD11 ' A' ' 57' ' ' LEU . 11.6 ptp180 -84.26 150.01 25.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.04 0.448 . . . . 0.0 111.519 -175.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -75.27 -25.45 58.02 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.997 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -90.92 9.94 28.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.835 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.447 ' HB2' ' HG3' ' A' ' 86' ' ' ARG . 58.0 t-105 -56.27 -47.6 78.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.756 -174.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.4 -16.52 64.15 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -177.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.4 m -99.6 -30.45 12.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.89 0.376 . . . . 0.0 111.285 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 29.7 m -93.0 -0.08 10.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.668 0.27 . . . . 0.0 110.7 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -55.39 -57.95 9.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.195 0.522 . . . . 0.0 110.554 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -64.63 -40.62 95.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.984 177.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -63.49 -53.65 48.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.566 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 45.1 t -60.18 -49.27 84.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.072 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.1 tpt -65.94 -38.91 89.83 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.908 -174.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.511 ' HD3' HD22 ' A' ' 148' ' ' LEU . 31.8 mtm180 -73.5 -22.63 60.09 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.444 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.414 ' HE2' ' CG1' ' A' ' 39' ' ' VAL . 86.9 tttt -72.97 -38.37 66.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.015 0.436 . . . . 0.0 109.858 176.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.77 -42.38 67.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.473 176.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.459 HD22 HD21 ' A' ' 149' ' ' LEU . 61.7 mt -63.13 -42.98 99.6 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.008 177.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 102' ' ' ARG . 40.7 ttm180 -52.35 -53.0 50.3 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.768 175.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.422 ' CB ' ' HB ' ' A' ' 37' ' ' ILE . . . -55.36 -43.62 75.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.002 -176.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -63.0 -52.14 64.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.685 0.279 . . . . 0.0 111.013 -176.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -77.37 -28.59 52.93 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -79.64 -46.21 17.62 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 122.248 -0.282 . . . . 0.0 111.15 -175.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -66.58 -38.95 88.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.88 0.371 . . . . 0.0 110.767 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -101.96 100.27 10.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.437 178.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.406 ' HA ' ' HB2' ' A' ' 112' ' ' ARG . . . -61.92 -22.64 65.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.106 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.8 mp0 -56.48 -49.58 74.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.909 175.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 51.3 mt -74.71 -33.93 62.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.953 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 109' ' ' ALA . 15.4 ttt180 -54.35 -51.14 65.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.274 177.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.7 -36.61 80.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.873 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.3 tp -65.23 -41.01 94.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.579 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.739 ' HG ' ' HB2' ' A' ' 153' ' ' ARG . 47.2 tp -63.78 -33.65 76.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.539 177.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.3 mt -81.19 -14.98 57.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.148 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.91 -30.51 21.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.182 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 18.1 p -72.36 -25.92 61.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.152 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.417 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -40.67 132.62 1.75 Allowed Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.147 173.286 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.728 ' HD2' HG21 ' A' ' 11' ' ' VAL . 28.2 Cg_endo -101.15 31.27 10.14 Favored 'Cis proline' 0 N--CA 1.459 -0.528 0 C-N-CA 124.702 -0.957 . . . . 0.0 112.807 -1.007 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -60.01 141.84 54.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.902 0.382 . . . . 0.0 111.658 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.512 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 17.3 ttpt -84.62 113.89 21.59 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.98 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 41.5 mt -81.47 116.88 21.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.776 -175.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.427 HG13 ' OD1' ' A' ' 143' ' ' ASN . 89.1 t -128.88 116.72 42.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.732 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.447 ' HA ' ' O ' ' A' ' 19' ' ' PHE . 37.0 tt0 -88.13 128.39 35.43 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.496 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 8.0 t60 -97.05 77.2 2.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.488 0.661 . . . . 0.0 110.223 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.4 m -104.49 101.02 10.7 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.94 -177.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.411 ' HG3' ' HA3' ' A' ' 137' ' ' GLY . 34.9 tt0 -84.98 -43.48 13.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.556 -173.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -62.68 -52.88 61.55 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -103.68 100.56 10.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.519 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.498 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -77.74 85.52 4.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.967 0.413 . . . . 0.0 110.391 178.645 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.405 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 5.4 t80 -170.03 118.79 0.59 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.698 ' HB3' HD22 ' A' ' 145' ' ' LEU . 3.7 m95 71.37 10.6 6.64 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.782 0.676 . . . . 0.0 111.571 -178.276 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -136.45 -153.89 6.65 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.389 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.496 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 2.1 p-10 -91.52 -13.54 31.95 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.345 0.593 . . . . 0.0 109.846 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' GLY . . . . . 0.498 ' HA2' ' HA ' ' A' ' 131' ' ' ALA . . . 77.06 -0.15 67.99 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.171 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.411 ' HA3' ' HG3' ' A' ' 128' ' ' GLU . . . 81.25 15.93 75.48 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.361 -0.447 . . . . 0.0 112.719 -177.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -168.1 -24.79 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -177.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 141.49 -49.65 0.76 Allowed Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.256 -0.973 . . . . 0.0 112.499 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -82.94 62.76 6.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.33 0.586 . . . . 0.0 110.126 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.18 8.62 9.03 Favored Glycine 0 C--N 1.315 -0.616 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.787 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 49.9 mttp 62.48 63.67 1.0 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 122.509 0.323 . . . . 0.0 111.228 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' ASN . . . . . 0.427 ' OD1' HG13 ' A' ' 124' ' ' VAL . 6.4 t30 -72.66 5.16 3.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.96 0.41 . . . . 0.0 111.304 -177.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.636 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 44.7 ttm180 -47.6 -25.91 1.3 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.761 177.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.698 HD22 ' HB3' ' A' ' 133' ' ' TRP . 20.4 tp -53.9 -47.17 71.43 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.857 0.36 . . . . 0.0 110.391 175.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -62.93 -36.05 92.89 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.96 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' TYR . . . . . 0.435 ' HA ' ' HE3' ' A' ' 150' ' ' MET . 86.4 t80 -67.08 -41.3 86.57 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 176.227 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 82.1 mt -61.1 -40.23 92.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.235 -0.439 . . . . 0.0 109.93 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.459 HD21 HD22 ' A' ' 101' ' ' LEU . 96.1 mt -60.06 -46.86 88.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.53 174.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.512 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 74.2 mtm -67.5 -39.54 85.17 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.798 -178.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -70.71 -35.62 72.84 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.542 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 54.9 tp -61.95 -45.77 92.24 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 173.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.739 ' HB2' ' HG ' ' A' ' 115' ' ' LEU . 0.6 OUTLIER -52.01 -42.46 63.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.877 175.461 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -62.03 -38.24 87.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.732 -177.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -73.48 -38.72 65.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.845 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 41.0 mt -67.09 -23.28 65.83 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.084 0.468 . . . . 0.0 110.715 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.32 72.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.218 173.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.56 -33.54 64.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.699 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.25 -49.65 63.63 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.36 0.6 . . . . 0.0 110.97 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 13.7 mttp -87.06 -20.83 26.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.296 -176.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 11.5 tp -63.7 -27.9 69.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.34 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 . . . . . 0 C--N 1.331 -0.197 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.803 179.993 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.452 -0.337 0 N-CA-C 110.564 -0.162 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 65.89 -81.13 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.957 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 61.1 90.77 0.06 Allowed 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.946 0.779 . . . . 0.0 111.919 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.494 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 12.5 mm-40 . . . . . 0 C--N 1.324 -0.517 0 CA-C-O 121.336 0.589 . . . . 0.0 111.127 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 N--CA 1.468 0.473 0 CA-C-O 121.18 0.514 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.484 HG11 ' HB2' ' A' ' 121' ' ' ALA . 28.3 m -129.25 -174.41 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.631 173.337 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.2 mmt -93.71 -74.26 0.54 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.17 0.509 . . . . 0.0 110.463 -173.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -176.48 121.83 0.15 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.929 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.6 t70 54.33 39.95 31.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.792 0.806 . . . . 0.0 110.055 -176.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.4 m -76.31 140.66 41.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.139 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.434 HG12 ' HB3' ' A' ' 122' ' ' LYS . 61.2 mt -115.62 121.51 67.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.4 mt -103.88 111.0 31.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.001 -175.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.611 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 82.3 m-20 -87.88 101.34 13.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.968 173.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.511 ' CD1' ' HB2' ' A' ' 29' ' ' PHE . 42.6 p90 -101.24 128.54 47.31 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.996 0.426 . . . . 0.0 110.962 -178.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -150.57 -179.19 7.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 173.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.0 m 71.3 84.82 0.13 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.638 0.732 . . . . 0.0 110.658 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.92 -9.82 58.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.233 -175.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.5 m -99.4 3.02 45.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.737 0.304 . . . . 0.0 110.855 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -93.35 -84.83 0.29 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.339 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -171.81 -46.6 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.595 0.236 . . . . 0.0 111.072 174.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -84.18 -4.8 59.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.366 0.603 . . . . 0.0 110.605 -174.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -79.13 -0.3 82.17 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.734 -0.667 . . . . 0.0 112.274 177.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -51.28 -33.5 28.88 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -177.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.511 ' HB2' ' CD1' ' A' ' 19' ' ' PHE . 89.0 m-85 -56.98 -19.07 16.12 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -176.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.3 t -75.45 147.71 39.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.197 0.522 . . . . 0.0 110.45 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -73.27 -10.03 59.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.214 -176.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -90.15 8.35 33.36 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.408 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.35 139.22 55.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.163 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.539 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -82.67 57.35 3.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.599 -176.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.447 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 76.1 m95 -118.32 115.92 35.74 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.493 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 35' ' ' TRP . 19.4 Cg_endo -60.48 136.61 68.68 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.996 2.464 . . . . 0.0 112.386 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.561 HG22 ' HA ' ' A' ' 104' ' ' LYS . 24.4 pt -123.8 176.43 5.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.053 -178.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 42.2 tptt -131.4 100.37 5.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.3 t -119.01 130.06 74.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.936 -174.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 62.8 9.52 3.69 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 124.044 0.84 . . . . 0.0 111.362 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.94 4.02 42.11 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.82 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -120.21 146.17 46.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 117.188 0.494 . . . . 0.0 110.952 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.1 m -79.17 131.67 36.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.303 176.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.443 ' HB2' HG13 ' A' ' 37' ' ' ILE . 86.8 m95 -122.46 137.26 27.48 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 176.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.44 -36.55 98.76 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.672 2.248 . . . . 0.0 112.437 -178.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.539 HG22 ' HA ' ' A' ' 34' ' ' ALA . 81.0 p -148.18 174.16 12.26 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.3 m -72.85 -28.42 62.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.307 0.575 . . . . 0.0 109.913 174.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -68.47 -36.09 78.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.256 -179.706 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.405 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 34.4 m80 -62.37 -36.39 82.12 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.407 0.146 . . . . 0.0 111.31 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -72.57 -37.85 68.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.014 0.435 . . . . 0.0 109.952 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -62.42 -47.62 83.28 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.726 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.574 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 64.6 mm-40 -64.72 -44.88 88.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.363 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.437 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -60.41 -36.54 78.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.305 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -71.26 -29.4 65.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.573 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.606 ' HE3' HD21 ' A' ' 85' ' ' LEU . 75.3 tttt -65.37 -43.64 90.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.787 176.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.728 ' HE1' ' HG3' ' A' ' 83' ' ' LYS . 75.5 m-85 -73.64 109.85 7.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.752 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.556 HD11 ' HB3' ' A' ' 86' ' ' ARG . 11.2 mp -85.3 34.6 0.57 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.811 0.815 . . . . 0.0 108.983 168.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 56' ' ' PHE . 9.9 t0 -116.59 111.02 19.3 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.387 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -55.08 -56.14 23.2 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -171.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 60' ' ' LYS . 4.3 mptp? -72.4 -26.39 61.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.603 0.239 . . . . 0.0 111.489 -176.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.558 ' O ' HG12 ' A' ' 65' ' ' ILE . 0.4 OUTLIER -74.5 -37.93 62.99 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 178.044 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.437 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.0 ttm180 -61.76 -40.78 96.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.182 0.515 . . . . 0.0 109.958 175.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.39 -39.7 94.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.723 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -64.2 -37.87 89.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.547 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.558 HG12 ' O ' ' A' ' 61' ' ' TYR . 44.5 mm -65.42 -35.2 74.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.863 0.363 . . . . 0.0 111.042 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.04 -22.45 52.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.268 0.556 . . . . 0.0 109.562 176.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -79.11 -18.8 52.61 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.417 -176.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.9 m -93.76 131.12 41.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.345 0.593 . . . . 0.0 110.726 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.2 p -88.0 -18.88 28.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.287 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.436 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 42.0 t -80.89 124.49 81.48 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.928 -177.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 18.5 Cg_exo -68.15 -39.81 9.83 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.236 2.624 . . . . 0.0 111.992 177.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.9 tpt -65.57 -35.35 80.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.757 -176.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.655 ' O ' ' HG2' ' A' ' 77' ' ' MET . 92.8 t -66.98 -44.15 88.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.392 178.178 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.39 -40.03 85.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.947 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.77 -37.79 85.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.8 0.334 . . . . 0.0 110.429 175.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -64.13 -37.9 89.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.302 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.655 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 6.7 mmt -60.31 -57.13 14.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.5 0.667 . . . . 0.0 109.973 176.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.574 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -80.5 3.08 75.35 Favored Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.121 -0.945 . . . . 0.0 113.346 -174.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -80.2 -19.54 46.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 117.088 0.444 . . . . 0.0 110.1 175.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -79.08 172.56 13.64 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.894 0.378 . . . . 0.0 110.001 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -134.14 1.69 3.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.949 0.404 . . . . 0.0 110.321 -176.247 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.6 p -88.24 -5.16 58.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.96 0.41 . . . . 0.0 111.58 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.807 ' HE3' ' HD2' ' A' ' 84' ' ' PRO . 30.4 mmmt -89.96 151.54 45.34 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.751 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.807 ' HD2' ' HE3' ' A' ' 83' ' ' LYS . 18.9 Cg_endo -57.19 119.01 5.99 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.286 2.658 . . . . 0.0 113.182 -177.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.606 HD21 ' HE3' ' A' ' 55' ' ' LYS . 57.8 mt -107.18 169.02 8.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.186 178.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.568 ' HG2' ' HB2' ' A' ' 89' ' ' TRP . 12.7 ptm180 -100.28 175.95 5.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.822 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -60.11 -69.31 0.22 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.253 -171.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -97.38 36.38 1.48 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.792 0.33 . . . . 0.0 111.108 -176.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.599 ' CZ2' ' HB2' ' A' ' 55' ' ' LYS . 33.3 t-105 -58.66 -35.13 72.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.859 0.361 . . . . 0.0 111.75 -178.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.428 ' CD ' ' HZ3' ' A' ' 93' ' ' LYS . 63.7 mm-40 -73.5 -16.99 61.27 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.295 -177.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.9 m -99.69 -37.54 9.07 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.877 0.37 . . . . 0.0 111.282 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.404 ' O ' HG23 ' A' ' 96' ' ' VAL . 34.0 m -85.81 3.01 4.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -172.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.526 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 59.0 mttp -55.11 -46.49 75.57 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.061 0.458 . . . . 0.0 111.5 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.456 ' HG2' ' H ' ' A' ' 94' ' ' GLU . 3.9 pt-20 -68.06 -25.43 65.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.348 -177.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -75.03 -43.81 51.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.906 0.384 . . . . 0.0 110.117 176.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 92' ' ' VAL . 88.9 t -61.16 -47.33 94.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.643 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.8 mtt -65.94 -32.94 74.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.492 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.687 HH21 HD23 ' A' ' 148' ' ' LEU . 27.7 ttm180 -60.87 -43.87 97.82 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.842 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -69.51 -40.49 76.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.76 0.314 . . . . 0.0 110.543 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.1 -47.64 76.48 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.45 HD13 HD21 ' A' ' 149' ' ' LEU . 69.9 mt -66.8 -37.04 83.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.291 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.511 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 52.1 ttt180 -60.21 -48.78 80.3 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.826 177.023 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.567 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -58.52 -30.43 67.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.889 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.561 ' HA ' HG22 ' A' ' 37' ' ' ILE . 55.9 tttt -66.05 -55.0 18.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.16 177.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -74.9 -10.87 59.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.099 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.539 ' HA ' HH21 ' A' ' 112' ' ' ARG . 60.3 mt-10 -88.3 -27.79 21.48 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.885 0.374 . . . . 0.0 110.395 172.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.567 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 1.3 tp-100 -86.42 -30.82 21.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.732 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -115.24 111.75 21.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.664 0.269 . . . . 0.0 110.818 -177.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.02 -39.35 91.99 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.974 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -53.38 -47.53 69.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.081 0.467 . . . . 0.0 110.93 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.441 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 22.3 mt -74.95 -31.16 61.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.439 -176.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.539 HH21 ' HA ' ' A' ' 106' ' ' GLU . 6.7 tpp180 -56.92 -50.45 72.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.529 176.003 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.99 -38.62 76.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.895 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 60.2 tp -60.3 -45.17 94.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 35.0 tp -62.08 -44.48 96.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.086 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.531 HD21 ' HB2' ' A' ' 156' ' ' LEU . 38.6 mt -74.72 -18.17 60.54 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.66 0.267 . . . . 0.0 111.21 -177.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.95 -23.22 52.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.446 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 57.9 p -71.88 -24.64 61.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.883 0.373 . . . . 0.0 110.931 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.474 ' HB2' ' HE ' ' A' ' 153' ' ' ARG . . . -47.84 136.47 10.62 Favored Pre-proline 0 C--O 1.234 0.25 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.891 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.432 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 27.6 Cg_endo -100.78 33.3 8.6 Favored 'Cis proline' 0 CA--C 1.534 0.511 0 C-N-CA 124.26 -1.142 . . . . 0.0 113.641 -1.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.484 ' HB2' HG11 ' A' ' 11' ' ' VAL . . . -67.53 159.06 30.5 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -175.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.434 ' HB3' HG12 ' A' ' 16' ' ' ILE . 44.3 tttp -88.27 121.33 30.54 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.759 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.0 mt -90.09 114.34 26.24 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.787 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.611 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 61.6 t -129.61 114.96 32.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.625 -0.262 . . . . 0.0 111.118 -178.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -74.18 118.53 17.24 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.513 ' HA ' ' HB2' ' A' ' 135' ' ' ASP . 80.8 t60 -85.53 77.51 9.85 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.865 -0.734 . . . . 0.0 109.188 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.51 107.31 9.87 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.633 178.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -106.61 15.93 25.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.553 0.692 . . . . 0.0 110.404 -175.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -125.98 -25.04 3.65 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.371 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -131.86 136.78 47.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.49 176.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.53 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -99.9 85.81 3.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.34 0.591 . . . . 0.0 109.843 173.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 5.6 t80 178.07 140.32 0.09 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.006 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.752 ' HB3' HD22 ' A' ' 145' ' ' LEU . 12.2 m95 74.93 6.29 4.33 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.872 0.732 . . . . 0.0 112.089 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -172.3 -113.85 0.31 Allowed Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 118.572 -1.775 . . . . 0.0 114.369 -178.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.513 ' HB2' ' HA ' ' A' ' 126' ' ' HIS . 9.8 t70 -98.57 -49.42 4.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.068 -0.566 . . . . 0.0 112.007 -167.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' GLY . . . . . 0.53 ' HA2' ' HA ' ' A' ' 131' ' ' ALA . . . 82.6 -6.22 70.41 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.981 -177.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 94.2 16.95 41.86 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.586 -0.606 . . . . 0.0 111.586 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 20.4 p80 -168.6 24.91 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.501 -0.35 . . . . 0.0 111.005 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 79.08 -46.29 2.93 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.389 -0.434 . . . . 0.0 113.891 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -88.25 68.18 8.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.126 0.965 . . . . 0.0 110.67 -173.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -122.87 15.42 8.38 Favored Glycine 0 C--N 1.311 -0.82 0 CA-C-N 114.002 -1.454 . . . . 0.0 111.86 177.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 45.9 mttt 72.55 80.87 0.14 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.492 0.663 . . . . 0.0 111.36 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' ASN . . . . . 0.406 HD21 ' HA ' ' A' ' 124' ' ' VAL . 4.9 t-20 -67.49 4.79 0.93 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.741 -1.118 . . . . 0.0 111.774 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.724 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 12.3 ttp180 -58.22 -22.1 50.61 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.866 -0.521 . . . . 0.0 112.239 -175.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.752 HD22 ' HB3' ' A' ' 133' ' ' TRP . 41.8 tp -66.08 -48.47 70.86 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 174.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -64.46 -28.9 73.77 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 174.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -68.83 -37.31 79.08 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 79.7 mt -58.85 -47.61 84.27 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 172.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.45 HD21 HD13 ' A' ' 101' ' ' LEU . 96.0 mt -61.77 -38.5 88.23 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.866 178.009 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.408 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 72.4 mtm -72.11 -40.16 68.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.656 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -67.19 -38.66 85.75 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.121 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.541 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 61.3 tp -62.32 -46.21 89.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.687 174.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.474 ' HE ' ' HB2' ' A' ' 119' ' ' ALA . 2.8 ttp-105 -52.23 -44.99 65.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.644 175.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -67.44 -38.83 85.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.6 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -72.61 -35.62 67.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.903 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 76.5 mt -74.78 -23.54 58.53 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 176.659 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.404 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -72.4 -25.16 61.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.441 175.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.73 -39.75 82.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 175.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -63.34 -38.54 91.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.341 174.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -63.88 -41.1 97.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.23 176.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' LEU . . . . . 0.404 HD13 ' O ' ' A' ' 157' ' ' ALA . 8.3 mp -67.4 -46.26 73.78 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.423 178.383 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 . . . . . 0 C--N 1.327 -0.376 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -176.311 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 37.6 t . . . . . 0 N--CA 1.453 -0.287 0 CA-C-O 121.297 0.57 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -107.42 29.8 6.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.314 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.85 76.75 1.15 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.142 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.577 178.795 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.4 m -70.99 151.38 9.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.966 0.413 . . . . 0.0 110.556 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.481 ' HG2' ' OG1' ' A' ' 15' ' ' THR . 0.0 OUTLIER -75.35 -66.66 0.74 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.234 -178.617 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' MET . 58.3 tt0 174.51 -39.11 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.164 -0.925 . . . . 0.0 109.047 176.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -82.78 12.28 4.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.431 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.501 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 18.0 m -82.44 138.75 34.31 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.576 -174.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.635 HG12 ' HE3' ' A' ' 122' ' ' LYS . 61.2 mt -124.81 120.81 59.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.201 174.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.2 mp -89.98 101.22 12.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.628 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 18.7 m120 -91.77 101.06 13.66 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 176.311 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.428 ' HB2' ' CB ' ' A' ' 26' ' ' TYR . 37.1 p90 -107.38 174.82 5.72 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.344 -174.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.57 -179.26 5.58 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.266 -177.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.481 ' HA ' ' OG ' ' A' ' 30' ' ' SER . 17.2 m -64.51 -173.51 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.84 0.713 . . . . 0.0 112.356 -176.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.718 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 34.2 p -67.34 2.69 1.55 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -169.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.4 t -92.93 12.06 25.15 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.372 0.606 . . . . 0.0 109.801 176.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -129.22 166.63 19.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.172 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -61.55 -35.29 77.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.893 0.378 . . . . 0.0 110.668 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.428 ' CB ' ' HB2' ' A' ' 19' ' ' PHE . 98.8 m-85 -80.76 -1.42 42.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.954 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.718 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -57.03 -23.0 44.69 Favored Glycine 0 CA--C 1.52 0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 114.408 -174.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -69.44 -14.19 62.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 117.524 0.662 . . . . 0.0 111.27 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -73.44 -38.92 65.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.801 -0.181 . . . . 0.0 110.851 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.481 ' OG ' ' HA ' ' A' ' 21' ' ' SER . 64.6 m -59.27 158.84 8.51 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.674 0.749 . . . . 0.0 112.964 -173.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -69.96 -19.82 63.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.549 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.624 ' CE1' ' HB2' ' A' ' 71' ' ' PRO . 13.0 t80 -92.54 7.24 44.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.542 -176.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.417 ' HB1' ' HD1' ' A' ' 35' ' ' TRP . . . -72.52 129.0 37.3 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.593 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.521 ' HA ' HG23 ' A' ' 46' ' ' THR . . . -80.17 60.39 3.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.255 0.55 . . . . 0.0 111.387 -175.007 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.417 ' HD1' ' HB1' ' A' ' 33' ' ' ALA . 58.5 m95 -111.16 112.43 55.15 Favored Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.388 174.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.446 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 42.2 Cg_exo -57.13 126.91 23.65 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 123.183 2.589 . . . . 0.0 113.237 -175.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.504 ' CG1' ' HB2' ' A' ' 44' ' ' TRP . 37.6 pt -103.33 145.2 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.49 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.514 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 14.9 tptm -108.39 92.59 4.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.957 0.408 . . . . 0.0 109.901 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 26.1 t -121.33 128.25 75.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.136 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.7 t70 66.8 16.91 10.49 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.811 0.815 . . . . 0.0 110.255 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.9 10.97 83.34 Favored Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.703 -176.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 57.6 mttp -111.01 143.26 41.98 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 56.8 m -94.48 113.28 25.1 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.534 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.504 ' HB2' ' CG1' ' A' ' 37' ' ' ILE . 62.4 m95 -104.31 126.0 32.72 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 176.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 23.3 Cg_exo -62.91 -13.63 36.01 Favored 'Trans proline' 0 N--CA 1.473 0.281 0 C-N-CA 123.177 2.585 . . . . 0.0 113.059 -175.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.521 HG23 ' HA ' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -164.91 151.8 10.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.069 -178.256 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.9 m -58.53 -34.1 70.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.102 0.477 . . . . 0.0 109.954 175.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 51' ' ' PHE . 15.9 tm-20 -54.1 -42.97 69.98 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.311 177.273 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -69.54 -37.19 76.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.6 -175.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.468 ' CE2' HG13 ' A' ' 96' ' ' VAL . 90.8 t80 -69.91 -35.95 75.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 176.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.476 ' CZ ' ' HZ2' ' A' ' 89' ' ' TRP . 68.6 t80 -56.29 -52.51 64.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.761 177.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.638 ' NE2' ' HA ' ' A' ' 75' ' ' ALA . 17.1 mm-40 -66.81 -50.11 63.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.134 -178.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.51 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -58.51 -30.47 67.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.353 -177.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.456 ' HG2' HG22 ' A' ' 96' ' ' VAL . 6.1 tp60 -78.4 -42.92 28.82 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.154 178.216 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.549 ' HG2' HD22 ' A' ' 85' ' ' LEU . 27.3 ttpp -57.06 -39.65 75.32 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.158 -177.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -92.46 139.77 30.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.401 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.825 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.5 pt? -113.45 18.4 17.73 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.371 0.605 . . . . 0.0 110.275 -178.186 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -96.11 128.25 42.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.631 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -60.75 -48.01 83.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.463 -177.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -59.12 -46.38 88.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.701 0.286 . . . . 0.0 111.498 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.522 ' CZ ' ' HE3' ' A' ' 83' ' ' LYS . 2.5 t80 -74.39 -32.59 62.78 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.01 -174.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.51 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 41.7 ttm180 -64.88 -35.32 80.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.226 0.536 . . . . 0.0 109.618 174.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.537 ' HG2' ' HD3' ' A' ' 67' ' ' ARG . 31.1 tt0 -70.24 -31.39 68.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.247 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -59.8 -48.85 80.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.042 0.449 . . . . 0.0 110.154 173.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.436 HG21 ' HB2' ' A' ' 52' ' ' GLN . 37.8 mm -62.14 -37.98 79.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.005 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -71.38 -23.81 61.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.019 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.537 ' HD3' ' HG2' ' A' ' 63' ' ' GLU . 25.5 mtp180 -99.78 13.68 32.87 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -173.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.7 m -118.69 132.41 68.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.073 0.463 . . . . 0.0 110.35 174.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.9 m -84.91 -30.72 24.14 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.084 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.431 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 39.6 m -81.19 122.2 81.2 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.036 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.624 ' HB2' ' CE1' ' A' ' 32' ' ' PHE . 10.8 Cg_exo -70.97 -33.31 12.2 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 123.073 2.515 . . . . 0.0 111.795 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.451 ' O ' ' HG3' ' A' ' 76' ' ' ARG . 52.3 ttm -60.82 -39.51 89.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.803 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.516 ' O ' ' HG3' ' A' ' 77' ' ' MET . 84.1 t -61.15 -52.0 66.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.327 177.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.7 98.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.025 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.638 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -60.32 -50.33 74.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.596 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 72' ' ' MET . 77.1 mtp180 -64.77 -47.78 76.93 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -175.323 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.516 ' HG3' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -85.01 -8.29 58.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.979 0.419 . . . . 0.0 111.391 -177.696 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -93.87 -17.09 42.36 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.916 176.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -89.87 -1.15 57.92 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -175.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -82.37 131.23 35.23 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.018 174.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -106.13 22.68 15.29 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.626 0.727 . . . . 0.0 110.459 -170.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 59.8 m -70.87 -36.8 72.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.729 173.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.522 ' HE3' ' CZ ' ' A' ' 61' ' ' TYR . 16.1 pttm -86.53 158.12 54.74 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.797 175.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.438 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 60.7 Cg_endo -71.71 154.71 59.28 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.616 2.211 . . . . 0.0 113.473 -174.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.549 HD22 ' HG2' ' A' ' 55' ' ' LYS . 52.9 mt -121.57 171.95 8.45 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 175.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -70.79 141.18 51.4 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.7 -0.8 . . . . 0.0 109.37 174.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.471 ' HE3' ' HB2' ' A' ' 87' ' ' LYS . 35.1 ttmt -61.24 -46.66 89.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.168 -169.253 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -86.75 24.29 1.5 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.485 ' HA ' HG22 ' A' ' 92' ' ' VAL . 65.7 t-105 -59.06 -36.03 74.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.737 0.304 . . . . 0.0 111.56 -177.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.89 -30.46 67.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.839 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 28.8 m -94.8 -40.58 9.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.849 0.356 . . . . 0.0 111.075 -177.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.5 m -79.06 -8.08 11.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -176.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 97' ' ' MET . 62.3 tttp -52.83 -46.5 67.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.653 0.264 . . . . 0.0 111.155 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -77.63 -28.83 51.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.696 0.284 . . . . 0.0 111.061 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -68.88 -42.25 77.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.088 0.471 . . . . 0.0 109.988 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.468 HG13 ' CE2' ' A' ' 50' ' ' TYR . 75.4 t -61.35 -46.76 95.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.396 176.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.456 ' HG2' ' O ' ' A' ' 93' ' ' LYS . 83.2 mmm -61.04 -40.07 92.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.809 178.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 25.7 ttm-85 -62.26 -43.64 98.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.544 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -61.9 -44.46 96.75 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.884 0.373 . . . . 0.0 110.589 178.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.92 -44.21 93.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.121 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -69.53 -41.22 76.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.014 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -58.34 -53.67 55.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.539 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.97 -26.56 68.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.949 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -65.06 -55.31 19.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.64 178.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -79.3 -6.39 56.61 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.947 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.778 ' HA ' HH21 ' A' ' 112' ' ' ARG . 20.9 mt-10 -92.08 -35.45 13.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.598 0.237 . . . . 0.0 110.999 173.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.514 ' NE2' ' HB2' ' A' ' 38' ' ' LYS . 0.8 OUTLIER -66.41 -45.1 81.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.027 0.442 . . . . 0.0 110.364 179.23 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -113.81 111.41 21.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.114 -176.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.36 -22.14 66.25 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.61 178.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -57.12 -49.02 77.21 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.362 0.601 . . . . 0.0 109.873 175.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.8 mt -69.32 -38.39 78.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.231 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.778 HH21 ' HA ' ' A' ' 106' ' ' GLU . 42.5 ttm180 -58.42 -43.7 88.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.508 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.94 -43.03 99.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.836 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.7 tp -65.97 -40.15 91.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.537 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.665 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 44.0 tp -65.62 -35.39 80.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.985 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.1 mp -88.55 -3.77 58.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.881 0.372 . . . . 0.0 111.077 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.12 -34.73 24.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.048 0.452 . . . . 0.0 109.792 172.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 20.9 p -75.23 -14.96 60.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.936 176.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.414 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -59.3 138.23 88.65 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.275 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 67.7 Cg_endo -104.99 39.66 3.47 Favored 'Cis proline' 0 N--CA 1.458 -0.6 0 C-N-CA 124.819 -0.909 . . . . 0.0 113.2 -2.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.501 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -75.48 176.28 7.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.94 0.4 . . . . 0.0 111.821 -176.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.635 ' HE3' HG12 ' A' ' 16' ' ' ILE . 51.6 mtmt -92.92 130.78 38.39 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.187 -179.44 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 59.8 mt -94.07 113.62 25.62 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.993 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.628 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 86.1 t -132.82 107.07 11.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.494 -175.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -77.34 117.82 19.2 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.439 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 7.4 t60 -85.71 113.32 21.81 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 3.6 t -136.95 112.49 9.34 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.382 0.611 . . . . 0.0 109.896 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.0 18.73 17.74 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.043 0.925 . . . . 0.0 108.548 171.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -95.53 -44.46 7.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.125 177.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -130.02 166.74 19.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.148 176.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.64 86.34 2.23 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.405 175.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -160.11 -35.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.124 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.671 ' HB3' HD22 ' A' ' 145' ' ' LEU . 71.5 m95 -120.79 20.71 11.63 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.485 -179.067 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -150.73 -150.31 5.26 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.43 -175.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.439 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 1.3 p-10 -82.43 -14.93 54.32 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 122.291 -0.534 . . . . 0.0 110.334 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' GLY . . . . . 0.569 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 68.0 26.42 73.99 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.886 176.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 76.81 -27.26 1.64 Allowed Glycine 0 CA--C 1.52 0.375 0 N-CA-C 114.31 0.484 . . . . 0.0 114.31 176.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' HIS . . . . . 0.468 ' NE2' ' HB3' ' A' ' 140' ' ' LYS . 20.7 p-80 -132.65 11.78 4.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.518 0.659 . . . . 0.0 111.801 -172.545 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 99.32 -27.09 21.72 Favored Glycine 0 CA--C 1.517 0.166 0 C-N-CA 120.552 -0.832 . . . . 0.0 113.048 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.468 ' HB3' ' NE2' ' A' ' 138' ' ' HIS . 65.6 tttp -107.4 69.97 0.77 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.587 0.708 . . . . 0.0 110.025 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.569 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -124.19 15.23 7.78 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.257 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 61.2 mttt 61.97 77.05 0.34 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.773 0.797 . . . . 0.0 110.929 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' ASN . . . . . 0.424 ' OD1' HG13 ' A' ' 124' ' ' VAL . 8.8 t30 -77.9 5.58 9.39 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.75 -176.052 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.493 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 69.0 mtp85 -47.37 -22.22 0.4 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -178.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.671 HD22 ' HB3' ' A' ' 133' ' ' TRP . 49.2 tp -56.59 -47.54 79.37 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.272 0.558 . . . . 0.0 110.237 173.264 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.613 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -67.42 -27.96 73.59 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.792 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -68.93 -37.87 79.17 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 79.6 mt -61.26 -41.87 97.67 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.6 -34.33 78.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.837 177.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.613 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 67.4 mtt -61.48 -49.24 77.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.73 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -67.38 -37.15 82.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.71 0.29 . . . . 0.0 110.805 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 68.1 tp -63.67 -42.77 98.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.032 0.444 . . . . 0.0 110.065 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.665 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 1.1 ttp-105 -61.7 -42.55 99.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.954 177.29 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -57.52 -43.97 84.72 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.219 177.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -66.65 -45.5 78.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.255 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.503 HD12 HD23 ' A' ' 115' ' ' LEU . 90.9 mt -69.41 -28.16 65.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.828 0.347 . . . . 0.0 110.627 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -60.8 -45.46 94.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.186 175.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 69.8 mt -69.14 -34.07 61.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.72 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -56.39 -52.8 63.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.045 0.45 . . . . 0.0 109.79 177.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -76.44 -25.2 54.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.769 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 13.7 tp -70.11 -32.56 70.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.195 0.521 . . . . 0.0 110.005 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.444 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.189 177.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 C--O 1.236 0.342 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -82.68 84.79 7.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.667 0.746 . . . . 0.0 109.941 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.95 44.75 1.15 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.682 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 . . . . . 0 C--N 1.328 -0.349 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 173.857 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.8 m80 . . . . . 0 N--CA 1.465 0.301 0 CA-C-O 121.117 0.484 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.421 HG21 ' HB2' ' A' ' 121' ' ' ALA . 32.3 m -83.73 179.91 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.909 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 29.0 mtm -91.92 164.33 13.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.02 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -58.08 116.75 3.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.338 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 52.01 74.16 0.28 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.523 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.43 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 31.5 m -96.8 121.72 38.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.858 177.045 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 35.3 mm -81.33 95.78 2.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 176.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.9 mt -90.07 91.61 3.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.443 0.639 . . . . 0.0 109.794 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.62 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.3 p30 -96.49 101.96 13.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.421 178.504 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -102.81 132.08 49.24 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.519 -172.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -150.2 100.47 2.9 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.566 173.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.515 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 18.4 t 176.29 61.7 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -177.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.2 m -74.53 2.72 9.01 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.32 -171.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.36 -79.0 0.02 OUTLIER 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -175.37 81.65 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -170.55 -110.43 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.883 -172.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -101.26 -15.69 17.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.2 0.524 . . . . 0.0 110.243 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.515 ' HA3' ' O ' ' A' ' 21' ' ' SER . . . -74.08 -0.45 56.45 Favored Glycine 0 CA--C 1.52 0.364 0 CA-C-N 115.863 -0.608 . . . . 0.0 113.303 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.36 -1.56 3.57 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.023 0.44 . . . . 0.0 112.004 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.409 ' O ' ' HE2' ' A' ' 104' ' ' LYS . 15.3 m-85 -65.17 -32.31 73.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.578 169.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.9 m -62.99 156.71 23.82 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.437 0.637 . . . . 0.0 112.046 -174.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.624 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 5.5 p-10 -70.66 -24.93 62.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.906 178.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -76.6 -2.26 31.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.715 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.442 ' O ' HG22 ' A' ' 46' ' ' THR . . . -64.72 136.1 56.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.945 -177.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.79 57.83 2.66 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.456 -172.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 66.2 m95 -116.63 105.5 49.88 Favored Pre-proline 0 C--N 1.316 -0.86 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.607 177.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.27 138.18 78.86 Favored 'Trans proline' 0 C--O 1.238 0.482 0 C-N-CA 123.324 2.683 . . . . 0.0 113.029 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.403 HG13 ' HB2' ' A' ' 44' ' ' TRP . 16.2 pt -123.81 137.65 56.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.363 -178.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.413 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 46.1 tptt -98.66 107.67 20.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.423 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.0 t -123.72 113.27 36.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -174.065 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 55.27 36.72 27.65 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.437 172.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.08 -1.18 62.74 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.502 173.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HE3' ' CZ2' ' A' ' 44' ' ' TRP . 54.4 mtmt -129.34 144.7 51.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 117.635 0.718 . . . . 0.0 110.42 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.0 m -98.53 122.74 42.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.861 -175.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.478 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 41.5 m95 -112.16 134.55 21.44 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.642 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 37.9 Cg_exo -60.79 -41.63 44.56 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.833 2.355 . . . . 0.0 112.554 -177.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.442 HG22 ' O ' ' A' ' 33' ' ' ALA . 21.0 p -144.77 178.63 7.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.698 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.624 ' HB2' ' HB2' ' A' ' 31' ' ' ASN . 21.5 m -74.02 -44.1 55.62 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -173.605 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.494 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 1.9 pm0 -76.93 -10.31 59.28 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.502 -173.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.538 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 11.2 m80 -71.74 -38.01 70.49 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 172.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -71.46 -35.81 70.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.494 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 83.0 t80 -59.89 -56.42 21.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.549 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.521 ' NE2' ' HA3' ' A' ' 78' ' ' GLY . 5.1 mm100 -66.28 -21.7 66.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.211 -0.45 . . . . 0.0 112.016 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.457 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -76.32 -48.99 18.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.004 0.43 . . . . 0.0 110.455 176.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -69.47 -14.48 62.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.136 0.493 . . . . 0.0 110.338 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -60.64 -34.45 74.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.769 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.514 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 96.8 m-85 -109.17 157.7 18.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.383 -178.188 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.461 HD12 ' H ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -112.14 32.7 5.33 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.265 0.555 . . . . 0.0 111.1 -177.883 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.504 ' OD2' ' HB2' ' A' ' 60' ' ' LYS . 8.6 t70 -136.0 118.34 15.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.518 178.278 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.58 ' HA ' ' HB2' ' A' ' 62' ' ' ARG . 21.4 mm-40 -65.97 -14.07 60.93 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -177.012 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.504 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . 58.4 mttp -72.71 -55.11 7.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.96 0.409 . . . . 0.0 109.956 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.42 ' O ' HG12 ' A' ' 65' ' ' ILE . 55.2 t80 -71.6 -26.0 62.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.933 0.397 . . . . 0.0 110.321 177.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.58 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . 12.5 mtp180 -71.44 -27.34 63.21 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.805 0.336 . . . . 0.0 110.507 175.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.3 tt0 -69.91 -32.38 70.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 170.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.02 -40.75 95.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.591 175.122 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.42 HG12 ' O ' ' A' ' 61' ' ' TYR . 40.5 mm -65.16 -29.79 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.693 0.758 . . . . 0.0 110.29 175.267 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -74.58 -29.54 61.37 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.267 174.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -81.01 -28.47 35.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.207 -177.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.458 ' O ' HG13 ' A' ' 68' ' ' VAL . 10.3 p -70.83 101.37 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.722 0.772 . . . . 0.0 110.139 177.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.9 m -76.05 -26.17 56.32 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.966 -177.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.479 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.1 m -78.97 133.47 61.46 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.395 178.253 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.538 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 28.0 Cg_exo -62.12 -65.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.359 2.706 . . . . 0.0 113.986 -175.004 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 27.8 ttt -68.95 -26.45 65.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.776 0.322 . . . . 0.0 111.5 -172.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 86.3 t -62.82 -28.88 45.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.041 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.77 -47.49 84.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.031 0.443 . . . . 0.0 110.707 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.99 -30.52 62.52 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.95 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.42 ' HE ' ' C ' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -63.11 -49.12 75.65 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.574 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -77.54 -24.67 49.87 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 176.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.521 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -76.78 -2.14 75.17 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.274 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 76' ' ' ARG . 21.3 mmt180 -67.18 -18.77 65.41 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 122.31 0.244 . . . . 0.0 110.883 170.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.523 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 20.5 t70 -69.07 134.12 48.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.024 0.44 . . . . 0.0 110.402 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 81' ' ' ARG . 24.6 ttp-105 -118.18 17.87 13.89 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.278 -175.282 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 88.2 p -98.13 0.39 45.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.503 0.668 . . . . 0.0 109.593 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.523 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 41.1 mmtm -95.75 153.26 39.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 174.044 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.69 103.85 1.71 Allowed 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 121.44 1.426 . . . . 0.0 112.075 -178.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.416 HD21 ' HG3' ' A' ' 81' ' ' ARG . 2.4 pp -109.68 169.85 8.44 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.165 176.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 -86.07 133.23 33.9 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.04 -176.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -70.6 -33.39 71.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.842 0.353 . . . . 0.0 111.0 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -85.4 9.98 14.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.096 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.468 ' HA ' HG22 ' A' ' 92' ' ' VAL . 67.8 t-105 -54.5 -30.44 53.43 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.969 0.414 . . . . 0.0 110.203 175.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -53.66 -32.23 50.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.618 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.2 m -99.82 -45.46 5.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.698 0.285 . . . . 0.0 111.498 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.468 HG22 ' HA ' ' A' ' 89' ' ' TRP . 31.9 m -74.94 -11.22 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -171.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.4 pttm -63.27 -29.59 70.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.771 0.32 . . . . 0.0 110.647 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.495 ' OE1' ' HD3' ' A' ' 144' ' ' ARG . 9.5 mm-40 -68.16 -39.89 82.47 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.644 0.735 . . . . 0.0 109.49 177.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -71.87 -41.66 67.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.882 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.416 HG21 ' CZ3' ' A' ' 89' ' ' TRP . 79.7 t -63.8 -39.55 85.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.065 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.8 mmt -62.49 -46.14 89.81 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.576 176.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.719 HH21 HD23 ' A' ' 148' ' ' LEU . 26.1 ttm180 -63.75 -32.57 74.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.35 . . . . 0.0 110.545 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -63.93 -50.33 69.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.365 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.36 87.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.976 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.6 -35.52 80.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.098 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -58.88 -53.83 53.97 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.4 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.95 -37.51 82.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.739 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.409 ' HE2' ' O ' ' A' ' 29' ' ' PHE . 59.0 tttp -52.61 -54.02 38.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.357 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -86.5 -8.38 57.62 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.714 ' HA ' HH21 ' A' ' 112' ' ' ARG . 24.9 mt-10 -92.61 -33.01 14.58 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 121.868 -0.52 . . . . 0.0 111.518 175.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.413 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 78.5 mm-40 -79.17 -30.87 43.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.674 0.273 . . . . 0.0 110.761 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -115.28 103.38 10.76 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.778 0.323 . . . . 0.0 110.997 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.474 ' HA ' ' HB3' ' A' ' 112' ' ' ARG . . . -65.26 -24.42 67.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.513 178.689 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.517 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 2.0 mp0 -51.4 -56.08 15.13 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.455 172.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.9 mt -74.2 -31.65 62.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.333 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.714 HH21 ' HA ' ' A' ' 106' ' ' GLU . 13.7 tpp85 -50.48 -60.62 2.82 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.316 177.428 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.16 -34.35 70.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.025 -176.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.91 -40.22 94.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.434 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 29.3 tp -67.64 -49.56 62.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.278 178.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.541 HD21 ' HB2' ' A' ' 156' ' ' LEU . 53.0 mt -63.56 -24.89 68.0 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -173.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -74.47 -7.22 52.28 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 72.0 p -86.8 -15.4 39.38 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.363 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.432 ' HA ' HH21 ' A' ' 153' ' ' ARG . . . -54.87 141.86 56.74 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.394 177.334 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.583 ' HA ' HH21 ' A' ' 153' ' ' ARG . 43.9 Cg_endo -101.22 41.94 3.45 Favored 'Cis proline' 0 CA--C 1.535 0.572 0 C-N-CA 124.5 -1.042 . . . . 0.0 113.134 -1.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.43 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -72.92 166.93 22.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.94 0.4 . . . . 0.0 111.704 -178.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.427 ' HE3' ' ND2' ' A' ' 143' ' ' ASN . 39.3 tttp -100.98 119.35 38.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.589 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 24.2 mt -88.7 125.35 34.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.433 -175.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.62 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 42.2 t -134.36 134.11 54.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.432 -175.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.517 ' HB3' ' HA3' ' A' ' 134' ' ' GLY . 0.0 OUTLIER -81.02 137.66 36.04 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.31 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 18' ' ' ASN . 23.7 t-160 -130.77 79.94 1.92 Allowed 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.55 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.5 t -87.55 166.22 14.9 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 164.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -140.16 67.75 1.37 Allowed 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.833 0.825 . . . . 0.0 110.454 -176.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -162.69 -44.85 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.866 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ASP . . . . . 0.507 ' O ' ' HA2' ' A' ' 136' ' ' GLY . 2.6 m-20 -125.9 -179.9 4.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -124.17 86.19 2.53 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 170.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -97.35 -49.55 4.88 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -167.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.629 ' HB3' ' HB2' ' A' ' 145' ' ' LEU . 78.9 m95 -140.06 25.18 2.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.457 0.646 . . . . 0.0 110.588 178.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.517 ' HA3' ' HB3' ' A' ' 125' ' ' GLU . . . -163.07 -84.22 0.05 OUTLIER Glycine 0 N--CA 1.439 -1.163 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.575 -177.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -160.1 164.28 33.17 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.502 -178.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' GLY . . . . . 0.507 ' HA2' ' O ' ' A' ' 130' ' ' ASP . . . -98.38 24.12 33.32 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 175.416 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 74.24 37.27 48.76 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 115.071 -0.565 . . . . 0.0 113.748 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 -144.58 -27.0 0.5 Allowed 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' A' ' 140' ' ' LYS . . . 99.71 56.44 0.96 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.282 -0.485 . . . . 0.0 113.218 174.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 139' ' ' GLY . 13.0 ttpp 169.86 69.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 123.675 0.79 . . . . 0.0 109.126 176.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -132.35 -65.11 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 119.333 -1.413 . . . . 0.0 114.363 -175.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 39.6 tttm -178.51 52.08 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.499 0.65 . . . . 0.0 111.088 -171.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' ASN . . . . . 0.509 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 49.6 t30 -69.28 5.29 1.32 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.076 0.95 . . . . 0.0 111.708 -177.102 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.702 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 1.6 ttt180 -57.58 -21.43 38.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.629 ' HB2' ' HB3' ' A' ' 133' ' ' TRP . 23.6 tp -65.53 -44.45 86.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.357 175.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -66.35 -32.14 81.06 Favored Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.177 175.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -61.85 -40.57 95.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.017 0.437 . . . . 0.0 110.032 175.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.719 HD23 HH21 ' A' ' 98' ' ' ARG . 46.4 mt -63.73 -45.5 89.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.767 174.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.4 mt -61.02 -46.24 91.53 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.33 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 58.1 mtm -64.84 -43.4 93.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.907 -176.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 155' ' ' GLN . 33.4 mt-10 -63.73 -44.97 91.96 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.64 176.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 58.7 tp -58.82 -45.21 90.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.182 0.515 . . . . 0.0 110.161 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.849 HH11 ' HB3' ' A' ' 153' ' ' ARG . 1.2 ttp-105 -57.82 -43.48 85.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.873 177.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.7 -40.79 97.66 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.802 177.357 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 151' ' ' GLU . 19.7 mm-40 -65.87 -41.45 91.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.749 179.437 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.541 ' HB2' HD21 ' A' ' 116' ' ' LEU . 97.2 mt -66.13 -36.36 82.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.859 0.361 . . . . 0.0 110.267 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -63.72 -42.48 97.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.858 177.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 77.5 mt -70.22 -43.79 78.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.704 0.288 . . . . 0.0 111.046 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -62.71 -29.12 70.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.293 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -87.28 -29.66 21.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.433 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 15.9 tp -62.05 -35.49 78.79 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.879 -177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 115.782 -0.644 . . . . 0.0 112.175 -176.307 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.479 ' O ' ' HB2' ' A' ' 25' ' ' ASP . 12.5 p . . . . . 0 C--O 1.225 -0.187 0 CA-C-O 120.378 0.133 . . . . 0.0 111.355 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 4' ' ' ARG . 14.7 mtp180 66.27 -79.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.303 -175.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.557 ' HB1' HD22 ' A' ' 114' ' ' LEU . . . 73.01 -40.29 0.47 Allowed 'General case' 0 N--CA 1.469 0.497 0 O-C-N 124.004 0.815 . . . . 0.0 112.062 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 . . . . . 0 C--N 1.325 -0.458 0 CA-C-O 120.905 0.383 . . . . 0.0 111.773 -178.856 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.2 t60 . . . . . 0 N--CA 1.465 0.305 0 CA-C-O 121.271 0.557 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -83.91 168.0 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.269 177.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.497 ' HG2' ' H ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -80.73 -84.55 0.1 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.965 -179.156 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.497 ' H ' ' HG2' ' A' ' 12' ' ' MET . 81.9 mm-40 -133.61 -72.17 0.5 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -175.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -137.16 86.8 2.23 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.712 -171.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.3 t -117.94 149.93 40.08 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.34 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.518 HD13 ' HB2' ' A' ' 122' ' ' LYS . 32.1 mm -94.68 113.18 28.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.924 177.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.0 mt -96.05 101.89 12.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 120.924 0.392 . . . . 0.0 110.301 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.428 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 22.9 m-80 -84.86 104.21 14.61 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.014 177.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -109.92 130.61 55.51 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.92 0.391 . . . . 0.0 110.467 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -150.54 137.82 19.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.968 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.1 m 73.18 130.41 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 O-C-N 124.144 0.902 . . . . 0.0 111.444 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.493 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 20.6 p -56.38 -30.7 63.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.827 -178.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.7 m 62.82 -85.94 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.691 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -160.41 -40.97 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 3' ' ' VAL . 4.3 p-10 -137.54 -52.7 0.65 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 120.154 -0.618 . . . . 0.0 112.595 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -77.68 -9.77 59.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.115 0.483 . . . . 0.0 111.59 -174.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.493 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -76.7 -0.52 68.55 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 116.187 -0.461 . . . . 0.0 113.279 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -53.07 -25.89 14.28 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -62.78 -18.91 63.42 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.9 m -78.84 136.73 37.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.978 0.418 . . . . 0.0 109.943 175.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.48 -15.65 62.87 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.837 -174.16 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.401 ' CE1' ' HB2' ' A' ' 71' ' ' PRO . 2.8 t80 -88.79 20.97 3.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.982 0.42 . . . . 0.0 110.955 -176.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.64 175.42 2.92 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.953 171.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -134.9 81.7 1.91 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.892 0.377 . . . . 0.0 111.681 -176.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.466 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 92.9 m95 -121.1 137.23 26.41 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.465 177.172 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 7.4 Cg_exo -72.03 112.08 3.33 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.748 2.299 . . . . 0.0 111.544 177.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.509 HG13 ' HB2' ' A' ' 44' ' ' TRP . 17.4 pt -107.27 117.21 52.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.319 0.58 . . . . 0.0 110.649 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -81.58 95.69 7.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.862 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.436 ' HB ' ' CD1' ' A' ' 44' ' ' TRP . 24.7 t -118.61 125.18 74.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.288 -177.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.6 t70 62.48 28.49 16.8 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.714 0.769 . . . . 0.0 110.07 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.32 7.34 87.78 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.375 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -117.67 137.23 52.8 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.648 0.261 . . . . 0.0 110.386 -176.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.1 m -87.72 98.03 11.22 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.434 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.509 ' HB2' HG13 ' A' ' 37' ' ' ILE . 66.9 m95 -90.41 126.19 57.3 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.465 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 11.2 Cg_exo -72.15 61.16 3.24 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.852 2.368 . . . . 0.0 112.418 178.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 48' ' ' GLU . 0.5 OUTLIER 93.2 165.15 0.03 OUTLIER 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.338 1.055 . . . . 0.0 111.323 172.821 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.4 p -52.41 -43.91 65.07 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.34 -173.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.405 ' H ' HG23 ' A' ' 46' ' ' THR . 21.7 tp10 -43.56 -45.28 6.56 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 123.553 0.533 . . . . 0.0 112.205 178.636 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -74.34 -46.17 42.45 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.141 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -60.72 -35.57 76.66 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.152 0.501 . . . . 0.0 110.522 175.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.473 ' CZ ' ' HZ2' ' A' ' 89' ' ' TRP . 81.4 t80 -59.95 -57.45 12.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.239 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -67.3 -34.0 76.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.324 -176.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.95 -30.65 71.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.902 0.382 . . . . 0.0 111.081 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.626 ' HG2' HG22 ' A' ' 96' ' ' VAL . 24.5 tp60 -85.95 -26.89 25.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.114 0.483 . . . . 0.0 109.893 178.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -67.84 -47.87 67.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.385 -178.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -90.47 143.17 27.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.05 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.66 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.2 pt? -102.66 3.13 36.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.0 110.328 176.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.32 122.87 22.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.639 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -63.58 -51.01 67.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.655 -173.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 63' ' ' GLU . 24.9 ttpp -68.44 -34.21 75.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.817 0.341 . . . . 0.0 110.359 -177.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.658 ' O ' HG12 ' A' ' 65' ' ' ILE . 2.0 t80 -68.34 -34.53 76.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.316 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.412 ' NH2' ' HA ' ' A' ' 57' ' ' LEU . 93.6 mtt180 -62.1 -35.72 79.54 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.989 0.423 . . . . 0.0 110.193 174.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.475 ' HB3' ' O ' ' A' ' 60' ' ' LYS . 10.1 tp10 -61.2 -45.65 93.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.696 174.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -62.04 -35.16 77.76 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.547 176.693 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 61' ' ' TYR . 48.9 mm -62.51 -40.35 87.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.795 0.331 . . . . 0.0 110.766 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -90.03 -0.41 57.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.173 0.511 . . . . 0.0 110.456 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.524 ' HB2' ' HA ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -83.03 -30.31 28.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.328 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.1 m -90.96 133.46 32.62 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.136 -176.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.3 m -81.72 -38.95 24.96 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.641 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.443 ' HB2' HG23 ' A' ' 73' ' ' VAL . 17.0 m -77.9 124.77 86.18 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.266 -177.198 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.401 ' HB2' ' CE1' ' A' ' 32' ' ' PHE . 35.5 Cg_endo -65.5 -27.86 53.93 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.72 2.28 . . . . 0.0 111.724 177.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 79.6 mtp -60.2 -39.24 85.87 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.887 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.571 ' O ' ' HG2' ' A' ' 77' ' ' MET . 46.0 t -66.53 -43.62 90.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.02 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.23 -47.37 85.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.941 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.543 ' O ' ' HG3' ' A' ' 79' ' ' ARG . . . -61.1 -47.8 84.63 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.891 0.377 . . . . 0.0 111.039 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -58.25 -49.56 76.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.86 -177.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.571 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 26.0 ptt? -81.66 -11.53 59.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.79 0.329 . . . . 0.0 110.94 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -81.26 -16.51 73.97 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.013 -0.613 . . . . 0.0 111.892 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 75' ' ' ALA . 92.9 mtt180 -79.74 -10.32 59.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.554 0.216 . . . . 0.0 110.963 175.276 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.487 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 22.3 t70 -72.09 140.22 48.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.673 -176.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 87.7 mtm-85 -122.95 20.27 10.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.873 0.368 . . . . 0.0 111.274 -177.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.8 p -98.17 5.69 48.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.556 0.693 . . . . 0.0 109.187 172.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.487 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 43.6 mmtm -102.69 159.28 29.81 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.255 175.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.84 108.08 0.85 Allowed 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.262 1.974 . . . . 0.0 112.498 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 89.0 mt -98.63 151.45 20.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.216 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.623 HH21 ' ND2' ' A' ' 88' ' ' ASN . 16.4 ptm180 -96.88 140.52 31.31 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.353 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.633 ' HE2' ' HA ' ' A' ' 87' ' ' LYS . 0.6 OUTLIER -78.07 -28.3 48.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.146 0.498 . . . . 0.0 109.944 -178.289 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.623 ' ND2' HH21 ' A' ' 86' ' ' ARG . 22.9 p-10 -83.26 15.86 2.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.853 178.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.483 ' HB2' ' HG3' ' A' ' 86' ' ' ARG . 38.0 t-105 -62.41 -37.39 85.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.111 175.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.8 -31.6 72.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.939 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.3 m -71.59 -46.63 58.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.199 -178.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.503 ' O ' HG23 ' A' ' 96' ' ' VAL . 34.8 m -92.37 -1.31 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.549 -175.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.596 ' HG2' ' HZ2' ' A' ' 133' ' ' TRP . 80.8 tttt -48.57 -53.2 19.27 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 123.383 0.673 . . . . 0.0 111.292 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -66.83 -40.58 88.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.855 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 -62.15 -49.74 74.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.953 -177.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.626 HG22 ' HG2' ' A' ' 54' ' ' GLN . 77.5 t -58.08 -48.98 82.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.895 -178.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 4.4 mmt -59.6 -53.77 54.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.677 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.43 ' HD3' HD22 ' A' ' 148' ' ' LEU . 38.8 ttp85 -69.94 -29.71 66.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.456 -174.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -70.49 -42.29 71.56 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.62 0.248 . . . . 0.0 110.512 178.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.71 -43.98 87.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.094 0.473 . . . . 0.0 110.283 178.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.503 HD13 HD21 ' A' ' 149' ' ' LEU . 76.6 mt -62.38 -42.64 99.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.756 176.551 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.523 ' HA ' HD21 ' A' ' 152' ' ' LEU . 41.4 ttm180 -56.27 -50.17 72.11 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.159 176.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.81 -37.09 70.7 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 123.487 0.492 . . . . 0.0 111.902 -177.289 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -68.11 -55.6 11.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.636 0.255 . . . . 0.0 110.816 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.534 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 84.2 m-85 -70.14 -29.69 66.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.917 0.389 . . . . 0.0 111.245 -177.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -67.48 -44.35 78.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.087 0.47 . . . . 0.0 110.595 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -84.68 -31.3 24.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.967 -172.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -108.74 110.83 22.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.263 0.554 . . . . 0.0 111.019 177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.48 -26.43 66.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.531 -177.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -58.94 -49.43 77.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.456 0.646 . . . . 0.0 109.837 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.05 -36.23 66.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.337 -175.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.534 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 1.6 ttp180 -65.34 -39.16 92.03 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.506 177.075 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.58 -45.07 95.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.979 175.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.557 HD22 ' HB1' ' A' ' 5' ' ' ALA . 61.5 tp -60.78 -47.14 87.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.611 177.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.529 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 53.2 tp -59.31 -50.51 73.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.184 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.511 HD13 ' HG3' ' A' ' 112' ' ' ARG . 9.5 mp -73.55 -11.31 60.4 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.05 -21.19 33.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.589 0.233 . . . . 0.0 111.194 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 77.6 p -82.66 -21.56 34.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.932 0.396 . . . . 0.0 110.861 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.513 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -59.71 141.48 88.82 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.185 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.7 Cg_endo -100.08 41.33 3.83 Favored 'Cis proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.222 -1.158 . . . . 0.0 113.676 1.077 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.51 165.3 24.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.827 0.346 . . . . 0.0 110.644 177.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.518 ' HB2' HD13 ' A' ' 16' ' ' ILE . 65.8 mttt -94.8 125.34 39.39 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.251 0.548 . . . . 0.0 111.343 -177.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 62.5 mt -86.64 101.35 13.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.185 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 87.0 t -116.1 106.55 20.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.351 -179.008 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -75.68 119.66 20.0 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 175.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -88.78 77.49 7.83 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.634 0.731 . . . . 0.0 109.153 -176.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.446 ' HB ' ' HA3' ' A' ' 134' ' ' GLY . 22.5 m -96.82 105.64 17.8 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.295 176.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -98.89 -9.23 24.47 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.727 -172.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' A' ' 130' ' ' ASP . 28.2 t-20 -96.52 96.55 8.75 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 129' ' ' ASN . 5.6 m-20 69.69 154.44 0.12 Allowed 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.985 0.803 . . . . 0.0 111.214 -172.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.413 ' HB1' ' HA3' ' A' ' 141' ' ' GLY . . . -99.54 85.6 3.18 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.35 0.595 . . . . 0.0 109.478 173.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.548 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 63.6 t80 -134.97 102.29 5.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.145 -178.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.737 ' HB3' HD22 ' A' ' 145' ' ' LEU . 78.5 m95 63.53 17.6 10.48 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.845 0.716 . . . . 0.0 110.209 -172.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.446 ' HA3' ' HB ' ' A' ' 127' ' ' THR . . . -148.46 155.76 26.56 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.528 ' CG ' ' HB2' ' A' ' 143' ' ' ASN . 2.9 m-20 -88.68 34.44 0.77 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -170.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 59.18 21.33 53.14 Favored Glycine 0 C--O 1.228 -0.28 0 C-N-CA 121.187 -0.53 . . . . 0.0 112.523 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 79.08 -53.11 4.11 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.68 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -67.91 -31.41 71.16 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.646 0.609 . . . . 0.0 112.646 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 119.83 42.15 0.54 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.996 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.5 tttt -172.77 87.32 0.07 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 174.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.413 ' HA3' ' HB1' ' A' ' 131' ' ' ALA . . . -152.74 -64.75 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 119.586 -1.292 . . . . 0.0 113.398 173.103 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.548 ' HD2' ' HA ' ' A' ' 132' ' ' TYR . 58.0 mttp -164.14 43.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.879 0.34 . . . . 0.0 111.029 -174.23 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' ASN . . . . . 0.528 ' HB2' ' CG ' ' A' ' 135' ' ' ASP . 63.9 t30 -61.1 4.95 0.07 Allowed 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 177.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.559 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 32.2 mtp180 -58.39 -24.13 59.11 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 122.167 -0.333 . . . . 0.0 110.916 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.737 HD22 ' HB3' ' A' ' 133' ' ' TRP . 47.5 tp -61.95 -50.67 71.19 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.006 0.431 . . . . 0.0 110.046 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.633 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -64.75 -32.82 85.47 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.545 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -65.44 -40.92 93.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.807 0.337 . . . . 0.0 110.437 176.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.0 mt -62.12 -38.7 89.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.004 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.503 HD21 HD13 ' A' ' 101' ' ' LEU . 77.8 mt -63.31 -36.93 85.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.82 176.049 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.633 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 60.8 mtt -61.73 -51.94 66.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.0 0.428 . . . . 0.0 110.128 177.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -63.37 -43.07 98.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.279 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.523 HD21 ' HA ' ' A' ' 102' ' ' ARG . 65.6 tp -61.37 -46.43 90.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.992 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.529 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 29.4 ttp85 -59.16 -39.45 82.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.713 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -65.3 -42.78 92.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.123 0.487 . . . . 0.0 110.106 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -63.59 -39.77 95.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.282 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.507 HD13 ' HD3' ' A' ' 112' ' ' ARG . 67.2 mt -78.9 -12.8 60.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.981 0.419 . . . . 0.0 110.516 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.494 ' HA ' HD21 ' A' ' 116' ' ' LEU . . . -78.66 -33.82 46.79 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.8 173.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.435 ' O ' ' HG3' ' A' ' 162' ' ' GLU . 1.4 mp -56.9 -38.28 58.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.835 177.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -63.42 -34.79 78.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.892 0.377 . . . . 0.0 110.46 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -72.79 -25.27 61.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.695 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.52 -23.72 61.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.878 0.37 . . . . 0.0 110.395 175.289 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 158' ' ' ILE . 46.0 mt-10 . . . . . 0 C--N 1.331 -0.223 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.376 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.4 t . . . . . 0 N--CA 1.465 0.298 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 61.8 mtm-85 -81.6 48.75 1.22 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.573 0.701 . . . . 0.0 110.977 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.449 ' HB1' HD13 ' A' ' 114' ' ' LEU . . . -85.63 -174.29 5.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.483 174.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 . . . . . 0 N--CA 1.463 0.194 0 O-C-N 123.13 0.269 . . . . 0.0 110.883 -179.141 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.8 m -84.98 -178.06 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.06 0.457 . . . . 0.0 110.799 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.4 mtm -100.28 165.83 11.28 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.844 -178.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.99 112.18 3.71 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 175.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 64.84 83.06 0.17 Allowed 'General case' 0 C--N 1.331 -0.231 0 O-C-N 123.943 0.777 . . . . 0.0 110.598 -174.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.475 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 31.7 m -115.12 120.49 39.95 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.398 177.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.423 HG12 ' HB3' ' A' ' 122' ' ' LYS . 31.6 mt -96.98 107.16 19.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.325 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.6 mt -101.64 101.14 11.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.706 -175.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.524 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 38.0 m-80 -87.3 105.02 16.95 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.529 175.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -110.77 166.77 10.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.33 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -150.12 122.9 8.66 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.538 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 81.2 p 56.57 -176.57 0.05 Allowed 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.0 0.92 . . . . 0.0 111.941 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.571 HG22 ' HA ' ' A' ' 28' ' ' ASP . 40.6 p -80.86 -27.84 36.25 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -172.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.5 p 50.98 -90.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.787 0.835 . . . . 0.0 112.045 -177.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -107.56 -93.3 0.4 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -131.95 0.48 3.87 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.018 0.437 . . . . 0.0 110.77 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -101.26 -13.85 17.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.103 0.478 . . . . 0.0 110.986 -176.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.492 ' C ' ' HA ' ' A' ' 22' ' ' THR . . . -94.08 0.24 66.46 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.126 -175.023 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.571 ' HA ' HG22 ' A' ' 22' ' ' THR . 36.3 m-20 -62.11 0.95 0.35 Allowed 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -174.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -62.3 -31.22 71.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.759 0.314 . . . . 0.0 110.25 171.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 74.7 m -58.48 153.15 16.52 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.511 0.672 . . . . 0.0 112.335 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 47' ' ' SER . 94.5 m-20 -76.85 -16.45 59.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.716 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -86.42 6.28 30.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.031 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.432 ' HB1' ' HD1' ' A' ' 35' ' ' TRP . . . -59.0 146.17 39.17 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.844 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.559 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -91.21 21.1 4.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.683 -173.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.465 ' HE1' ' CG ' ' A' ' 28' ' ' ASP . 77.4 m95 -89.85 124.85 62.67 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-O 120.713 0.292 . . . . 0.0 110.959 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.443 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 36.6 Cg_endo -66.71 128.59 19.26 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.554 2.169 . . . . 0.0 111.931 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.627 HG22 ' HA ' ' A' ' 104' ' ' LYS . 16.0 pt -103.12 137.75 30.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.915 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.466 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 43.4 tptt -100.2 101.18 12.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.057 -178.249 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.433 ' O ' ' HB3' ' A' ' 40' ' ' ASP . 42.1 t -115.63 125.03 72.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.469 -178.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.433 ' HB3' ' O ' ' A' ' 39' ' ' VAL . 20.6 t70 74.96 -62.67 0.45 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.363 1.078 . . . . 0.0 110.174 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.31 28.69 0.04 OUTLIER Glycine 0 C--N 1.298 -1.53 0 CA-C-N 113.3 -1.773 . . . . 0.0 109.928 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.1 mttp -135.39 142.01 45.6 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -172.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.9 m -102.09 106.42 17.3 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.764 -175.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.479 ' HB2' HG13 ' A' ' 37' ' ' ILE . 49.4 m95 -93.25 122.34 63.4 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.587 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 44' ' ' TRP . 4.4 Cg_endo -48.26 -36.31 29.24 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.698 2.932 . . . . 0.0 114.007 -175.337 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.559 HG22 ' HA ' ' A' ' 34' ' ' ALA . 55.2 p -148.3 166.22 28.68 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.284 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.405 ' HB3' ' O ' ' A' ' 31' ' ' ASN . 22.9 t -63.41 -39.88 95.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.589 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.65 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 5.0 mm-40 -57.64 -37.64 73.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.834 178.076 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.415 ' CG ' ' HG2' ' A' ' 45' ' ' PRO . 25.7 m80 -60.93 -43.87 98.02 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.551 0.215 . . . . 0.0 111.332 -178.063 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -68.49 -38.83 81.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.887 0.375 . . . . 0.0 110.683 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -62.71 -45.76 91.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.616 -179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.65 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 53.0 mm-40 -70.06 -33.91 72.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.749 -178.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.34 -44.61 82.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.426 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -81.62 -12.04 58.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.309 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.585 ' HE3' ' HA ' ' A' ' 79' ' ' ARG . 51.1 tttm -65.95 -28.34 68.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.708 175.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.624 ' CE1' ' HB2' ' A' ' 83' ' ' LYS . 96.3 m-85 -110.71 166.5 10.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.182 0.515 . . . . 0.0 111.185 -178.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.627 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.2 pt? -123.25 2.71 9.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.438 175.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -76.27 138.59 40.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.649 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -62.92 -56.15 19.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.562 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -58.84 -47.56 84.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.986 -173.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.488 ' CE2' ' HG3' ' A' ' 83' ' ' LYS . 0.5 OUTLIER -72.67 -41.19 65.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.089 -172.936 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -66.36 -30.97 71.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.433 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.408 ' CD ' HH21 ' A' ' 66' ' ' ARG . 14.1 tp10 -62.93 -47.48 83.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.037 174.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -61.63 -52.59 63.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.413 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.422 HG21 ' HB2' ' A' ' 52' ' ' GLN . 65.1 mt -63.32 -27.73 43.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.682 -175.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.408 HH21 ' CD ' ' A' ' 63' ' ' GLU . 46.4 ttp180 -73.49 -34.08 65.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.762 0.315 . . . . 0.0 111.346 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -99.14 -16.62 18.54 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -173.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.98 127.93 32.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.887 0.375 . . . . 0.0 110.057 178.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 p -85.12 -35.43 21.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.772 0.32 . . . . 0.0 110.935 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.476 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 15.5 m -58.61 116.19 14.33 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.616 -178.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 10.1 Cg_exo -71.99 -44.26 0.97 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.013 2.475 . . . . 0.0 112.529 -178.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.448 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 13.7 tpt -63.55 -42.92 98.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.413 -177.132 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 64.9 t -65.49 -41.15 90.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.901 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.8 -44.68 90.83 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.312 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.09 -34.81 64.1 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.978 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 72' ' ' MET . 0.7 OUTLIER -65.21 -45.9 82.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.171 -176.825 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -94.14 -2.04 53.3 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.009 0.433 . . . . 0.0 110.423 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.57 -51.26 4.39 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.298 -178.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.585 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 84.5 mtm-85 -82.68 25.3 0.66 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.33 0.586 . . . . 0.0 110.747 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -73.57 157.75 36.11 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.454 174.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 52.2 mtm180 -122.89 8.7 9.36 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.1 m -68.67 -28.04 66.51 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 170.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.624 ' HB2' ' CE1' ' A' ' 56' ' ' PHE . 25.5 mmtm -94.49 154.41 40.19 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.908 177.648 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.56 171.8 14.65 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.492 2.128 . . . . 0.0 112.791 -177.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 93.8 mt -126.94 173.41 9.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.309 0.576 . . . . 0.0 111.314 -178.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -84.28 152.73 23.98 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.022 177.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -78.89 -29.43 44.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.434 0.635 . . . . 0.0 109.76 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 22.3 p30 -92.18 13.53 18.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.604 176.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.596 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 42.5 t-105 -57.72 -29.58 64.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.55 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.558 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 28.8 mm-40 -63.92 -37.58 87.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.319 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.3 t -90.35 -20.82 22.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.773 0.32 . . . . 0.0 111.837 -174.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.53 ' HA ' ' HB3' ' A' ' 95' ' ' GLN . 34.1 m -101.41 -6.05 9.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -170.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.596 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 57.3 mttp -52.62 -65.02 0.63 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.524 0.678 . . . . 0.0 110.752 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.661 ' OE2' ' HD3' ' A' ' 144' ' ' ARG . 34.9 mt-10 -86.75 -5.06 59.23 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.84 -175.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.53 ' HB3' ' HA ' ' A' ' 92' ' ' VAL . 51.7 tt0 -80.98 -47.36 13.74 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.489 175.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 53.3 t -65.9 -38.21 81.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.35 176.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.761 ' HG3' ' CH2' ' A' ' 133' ' ' TRP . 1.0 OUTLIER -61.81 -43.79 98.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.07 177.655 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -56.46 -44.93 81.0 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.175 0.512 . . . . 0.0 110.304 175.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -62.56 -43.39 98.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.562 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.83 80.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.139 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 97' ' ' MET . 69.2 mt -63.3 -43.57 97.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.585 177.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.45 ' HA ' HD21 ' A' ' 152' ' ' LEU . 76.5 ttt180 -62.79 -42.89 99.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.035 177.183 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.671 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -59.02 -45.3 91.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.609 177.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.627 ' HA ' HG22 ' A' ' 37' ' ' ILE . 37.2 ttmt -56.38 -58.84 6.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.297 -179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.433 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 91.7 m-85 -80.09 -42.56 23.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -172.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -74.83 -22.51 58.66 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.982 -0.449 . . . . 0.0 111.497 -172.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.671 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 2.8 mp0 -83.5 -37.72 22.72 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.923 176.224 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.413 ' CE1' ' HE3' ' A' ' 35' ' ' TRP . 78.6 m-70 -98.36 104.56 16.61 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.77 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.79 -30.0 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.67 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.438 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.4 mp0 -56.33 -52.04 66.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.543 0.687 . . . . 0.0 110.008 176.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 40.0 mt -78.87 -31.47 45.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.442 -176.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.776 ' HG3' HD13 ' A' ' 156' ' ' LEU . 18.9 ttt180 -63.03 -43.88 97.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.128 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.34 -35.64 78.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.444 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.449 HD13 ' HB1' ' A' ' 5' ' ' ALA . 36.1 tp -64.82 -42.82 94.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.404 178.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.53 HD23 HD12 ' A' ' 156' ' ' LEU . 61.0 tp -62.36 -41.2 98.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.209 0.528 . . . . 0.0 110.726 178.227 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 87.1 mt -77.7 -14.12 59.7 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.976 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -81.1 -34.61 32.48 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.544 176.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 22.9 p -75.14 -11.92 60.19 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.213 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -57.38 134.59 81.6 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.502 174.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.2 Cg_endo -106.24 69.37 0.23 Allowed 'Cis proline' 0 C--N 1.354 0.817 0 CA-C-N 118.917 0.649 . . . . 0.0 113.112 -5.091 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -88.85 158.4 18.12 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.423 ' HB3' HG12 ' A' ' 16' ' ' ILE . 20.8 ttmm -88.19 105.95 17.87 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 176.648 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 29.5 mt -81.09 119.14 23.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.126 -173.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.524 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 47.3 t -134.95 123.6 41.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.9 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -98.85 137.09 37.92 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 172.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.418 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 81.1 t60 -98.91 77.56 2.22 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -177.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 5.7 t -100.01 94.98 6.55 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 122.298 1.047 . . . . 0.0 111.649 -173.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.505 ' HB3' ' HA3' ' A' ' 137' ' ' GLY . 3.0 pt-20 -83.27 14.36 3.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.894 170.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -82.37 -51.92 7.4 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.489 -1.232 . . . . 0.0 108.886 173.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -144.46 108.38 4.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.804 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.3 85.91 4.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.996 0.427 . . . . 0.0 111.182 -177.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.58 ' O ' ' HB3' ' A' ' 142' ' ' LYS . 35.5 t80 -169.17 -28.41 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.659 177.29 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.776 ' HB3' HD22 ' A' ' 145' ' ' LEU . 47.3 m95 -111.8 77.22 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.529 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 112.39 -140.43 16.23 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 -178.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.403 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 6.2 t0 -86.53 133.02 33.77 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 117.03 0.415 . . . . 0.0 110.222 176.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -84.55 32.33 3.4 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.127 -0.559 . . . . 0.0 112.804 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.505 ' HA3' ' HB3' ' A' ' 128' ' ' GLU . . . 80.95 13.45 81.2 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 121.185 -0.531 . . . . 0.0 114.091 174.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -154.35 12.15 0.41 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.955 0.877 . . . . 0.0 112.744 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 98.86 5.37 56.55 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 121.042 -0.599 . . . . 0.0 114.096 172.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -167.32 97.27 0.5 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 117.257 0.529 . . . . 0.0 111.253 176.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.33 -64.91 0.2 Allowed Glycine 0 C--N 1.31 -0.863 0 C-N-CA 120.481 -0.866 . . . . 0.0 111.332 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 132' ' ' TYR . 37.6 tttm -177.96 83.86 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.27 5.28 0.57 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.187 -174.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.661 ' HD3' ' OE2' ' A' ' 94' ' ' GLU . 51.2 ttt180 -62.48 -24.13 67.3 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -175.062 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.776 HD22 ' HB3' ' A' ' 133' ' ' TRP . 31.1 tp -58.57 -50.77 72.6 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 175.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.585 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -66.52 -28.62 73.84 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.925 176.475 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -68.78 -38.7 80.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.755 0.312 . . . . 0.0 110.328 177.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 96.3 mt -61.16 -37.55 83.28 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 174.532 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 153' ' ' ARG . 96.0 mt -64.9 -37.88 89.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.511 176.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.585 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 58.2 mtt -63.0 -51.77 65.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.875 0.369 . . . . 0.0 110.166 176.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -59.11 -44.41 91.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.459 -178.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 55.7 tp -67.11 -40.24 86.83 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.009 178.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.828 HH11 ' HB3' ' A' ' 153' ' ' ARG . 1.4 ttp-105 -57.8 -43.56 85.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.465 -179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.18 -46.42 82.84 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.278 175.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.0 -51.39 69.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.518 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.776 HD13 ' HG3' ' A' ' 112' ' ' ARG . 20.9 mt -63.33 -30.78 71.85 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.909 -175.326 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -69.0 -48.15 63.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.324 175.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.552 ' O ' ' HG3' ' A' ' 162' ' ' GLU . 81.7 mt -64.01 -39.05 84.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.202 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -56.11 -47.21 78.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.978 0.418 . . . . 0.0 110.552 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -84.05 -15.95 45.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.117 0.484 . . . . 0.0 110.418 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 14.4 tp -72.38 -19.06 61.68 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 175.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.552 ' HG3' ' O ' ' A' ' 158' ' ' ILE . 42.0 mt-10 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.998 176.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 20.4 t . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -87.39 101.03 13.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.887 0.375 . . . . 0.0 111.013 -173.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.78 124.88 30.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.263 177.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 . . . . . 0 C--N 1.326 -0.445 0 CA-C-O 120.755 0.312 . . . . 0.0 110.362 -178.805 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.1 m170 . . . . . 0 N--CA 1.462 0.158 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.429 HG21 ' HD2' ' A' ' 120' ' ' PRO . 29.1 m -83.46 15.27 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.727 -173.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 38.5 mtm 63.94 40.9 6.98 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.537 171.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 70.43 -69.4 0.18 Allowed 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.709 0.631 . . . . 0.0 111.733 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -140.18 87.78 2.17 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.61 -174.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.4 t -101.65 142.08 33.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.119 176.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.422 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.0 mp -96.15 105.61 17.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.4 mt -89.85 115.26 29.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.034 0.445 . . . . 0.0 110.347 -175.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -93.93 108.68 20.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.43 -177.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 31.4 p90 -114.25 113.79 25.09 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.086 0.47 . . . . 0.0 110.394 177.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.512 ' O ' ' HB2' ' A' ' 21' ' ' SER . 16.9 t80 -150.17 100.22 2.88 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 174.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 33.8 t 161.34 115.58 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.23 0 O-C-N 124.205 0.941 . . . . 0.0 109.008 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 m -87.94 2.47 51.56 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.241 0.543 . . . . 0.0 110.245 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.9 m -110.1 20.03 18.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.05 -177.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -126.29 157.63 37.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.966 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.91 -33.06 74.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.868 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -87.62 -1.52 58.01 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.6 0.714 . . . . 0.0 109.86 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.25 -0.29 56.61 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.261 -177.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -51.69 -30.74 23.28 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -72.9 -0.79 14.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.734 0.302 . . . . 0.0 111.701 -177.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.9 t -75.06 139.78 43.05 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -77.63 -3.2 39.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.004 0.431 . . . . 0.0 110.573 178.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -106.77 12.01 29.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.37 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.2 137.14 57.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.855 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.94 58.18 2.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.297 0.57 . . . . 0.0 111.595 -174.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.417 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 95.9 m95 -112.0 118.81 45.62 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.966 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 35' ' ' TRP . 36.9 Cg_endo -66.78 134.53 35.2 Favored 'Trans proline' 0 C--O 1.239 0.534 0 C-N-CA 122.624 2.216 . . . . 0.0 111.501 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.548 HG22 ' HA ' ' A' ' 104' ' ' LYS . 29.8 pt -121.85 155.84 26.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.101 0.477 . . . . 0.0 110.925 -176.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.596 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 1.2 tmtp? -117.31 107.07 13.95 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 -178.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.4 ' C ' ' H ' ' A' ' 41' ' ' GLY . 7.7 t -127.21 127.88 69.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.072 -173.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 27.6 t70 73.64 -19.94 0.32 Allowed 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.712 0.633 . . . . 0.0 111.84 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.539 ' HA2' ' HE2' ' A' ' 38' ' ' LYS . . . 125.79 1.86 7.47 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 -171.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -109.52 134.98 51.25 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.241 -0.48 . . . . 0.0 110.1 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.3 m -84.17 116.5 22.95 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.167 176.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.48 ' HB2' HG13 ' A' ' 37' ' ' ILE . 80.0 m95 -106.06 130.74 22.51 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.837 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.65 -26.16 69.02 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.695 2.263 . . . . 0.0 112.945 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.81 ' HB ' ' OE1' ' A' ' 48' ' ' GLU . 0.1 OUTLIER -159.71 173.7 15.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.329 -178.044 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.0 m -77.87 -48.34 16.65 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -171.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.81 ' OE1' ' HB ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -59.94 -25.97 65.59 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.178 -178.844 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.493 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 54.3 m80 -59.82 -43.4 94.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.005 176.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -67.22 -44.69 78.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.945 0.402 . . . . 0.0 110.074 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -60.87 -46.59 90.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.638 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.47 ' CG ' ' HA3' ' A' ' 78' ' ' GLY . 2.4 tp-100 -65.08 -32.4 74.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.809 -177.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.408 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -73.74 -46.06 48.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.53 -178.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -77.83 -9.54 59.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.181 0.515 . . . . 0.0 110.756 -177.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.413 ' HA ' ' CZ3' ' A' ' 89' ' ' TRP . 86.8 tttt -63.43 -29.17 70.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.045 175.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -109.17 167.09 10.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.78 -177.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.444 HD11 ' HG2' ' A' ' 86' ' ' ARG . 5.2 mp -96.57 -37.19 10.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.934 -176.502 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.556 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 24.5 t70 -63.38 126.63 28.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.822 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.63 -32.37 67.88 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -173.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.8 ttpp -64.35 -40.9 96.77 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.16 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.479 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 0.5 OUTLIER -66.45 -32.25 73.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.712 -179.628 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.556 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 65.0 mtt180 -63.67 -45.2 91.21 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.368 0.604 . . . . 0.0 109.556 176.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -77.59 -16.36 58.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.386 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.479 ' HB2' ' HA ' ' A' ' 61' ' ' TYR . 6.3 tp10 -66.82 -45.81 77.13 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.53 ' O ' HG12 ' A' ' 68' ' ' VAL . 1.9 mp -70.79 -31.4 45.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.731 175.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.4 ' HG2' ' O ' ' A' ' 66' ' ' ARG . 70.8 ttt180 -72.57 -11.54 60.69 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.009 0.433 . . . . 0.0 110.644 175.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -85.24 -7.95 58.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.132 0.491 . . . . 0.0 110.402 -177.901 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.56 HG21 ' HB ' ' A' ' 73' ' ' VAL . 7.5 p -115.36 138.43 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.792 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 39.3 t -90.35 -32.41 16.48 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.798 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.457 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 31.4 t -68.71 121.41 81.06 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.708 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.493 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 22.4 Cg_exo -66.05 -32.83 43.15 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.121 2.547 . . . . 0.0 112.26 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 46.3 ttm -67.8 -41.44 83.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.696 -177.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.56 ' HB ' HG21 ' A' ' 68' ' ' VAL . 87.1 t -66.3 -36.2 76.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.447 178.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.43 -44.28 95.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.247 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.417 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -63.44 -39.43 94.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.73 177.609 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -56.51 -53.84 52.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.693 178.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 54.0 mtm -70.56 -30.54 67.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.914 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.47 ' HA3' ' CG ' ' A' ' 52' ' ' GLN . . . -81.95 -7.22 88.19 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.943 -178.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 40.9 ttt180 -89.24 -0.94 57.85 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 122.539 -0.389 . . . . 0.0 110.627 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.443 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 30.2 t70 -71.12 112.38 7.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.047 0.451 . . . . 0.0 110.499 -179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -96.16 10.82 36.5 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.325 0.583 . . . . 0.0 110.16 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 m -74.13 -24.4 59.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.643 176.088 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.443 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 49.2 mmtm -75.78 147.0 80.62 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.576 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -62.51 120.58 8.18 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.319 2.013 . . . . 0.0 111.215 173.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 89.4 mt -86.74 150.95 23.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.804 -176.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.572 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 22.7 mtp180 -68.83 130.63 43.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.36 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -58.06 -43.09 86.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.976 0.417 . . . . 0.0 111.603 -177.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -103.32 33.23 3.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.835 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.572 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 43.8 t-105 -60.09 -40.11 88.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.776 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.477 ' HA ' ' HE3' ' A' ' 93' ' ' LYS . 12.4 pt-20 -68.23 -23.38 64.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.697 0.284 . . . . 0.0 111.211 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.0 m -84.38 -20.15 32.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.15 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.6 m -114.3 6.99 7.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 110.607 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.477 ' HE3' ' HA ' ' A' ' 90' ' ' GLU . 38.4 ttmt -58.78 -53.01 63.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.649 -176.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -25.5 49.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.469 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.823 ' HA ' ' HD2' ' A' ' 98' ' ' ARG . 34.0 tt0 -58.68 -56.06 27.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.631 174.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.9 -43.99 96.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.823 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 47.0 ttm -65.05 -43.92 90.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.774 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.823 ' HD2' ' HA ' ' A' ' 95' ' ' GLN . 0.8 OUTLIER -66.65 -29.32 69.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.441 -178.535 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.446 ' N ' ' HG2' ' A' ' 98' ' ' ARG . 88.3 tttt -71.12 -42.79 68.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.021 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.62 87.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.428 176.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.407 ' HA ' HD23 ' A' ' 101' ' ' LEU . 22.4 mt -60.91 -41.76 96.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.227 178.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.705 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 58.4 ttt180 -61.01 -48.65 80.83 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 120.383 -0.527 . . . . 0.0 109.882 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -55.9 -36.69 67.94 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.115 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.548 ' HA ' HG22 ' A' ' 37' ' ' ILE . 63.5 tttm -59.21 -50.61 73.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.171 178.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -81.79 -26.21 34.6 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -177.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.705 ' HG3' ' HG2' ' A' ' 102' ' ' ARG . 5.9 mm-40 -74.98 -35.79 62.04 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.729 0.3 . . . . 0.0 111.759 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.596 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 77.2 mm-40 -84.21 -11.46 56.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.985 0.422 . . . . 0.0 110.905 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -129.2 99.21 5.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.811 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -59.67 -29.9 68.39 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.486 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.9 mp0 -53.26 -51.79 61.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.074 175.314 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 29.0 mt -75.42 -33.7 60.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.48 -176.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 24.6 ttt-85 -57.96 -41.77 83.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.114 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.7 -43.12 73.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.792 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 63.7 tp -57.11 -44.28 83.11 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.784 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.441 HD23 HD12 ' A' ' 156' ' ' LEU . 40.5 tp -62.76 -45.89 90.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.274 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 156' ' ' LEU . 79.0 mt -70.37 -18.28 63.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.719 0.295 . . . . 0.0 111.629 -176.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -73.9 -21.9 59.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.631 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.1 p -75.67 -27.28 58.26 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -176.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.518 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -48.78 137.78 12.76 Favored Pre-proline 0 N--CA 1.467 0.379 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.245 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.429 ' HD2' HG21 ' A' ' 11' ' ' VAL . 94.5 Cg_endo -100.75 33.74 8.3 Favored 'Cis proline' 0 N--CA 1.458 -0.588 0 C-N-CA 124.554 -1.019 . . . . 0.0 112.941 -2.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -62.84 159.42 16.65 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.976 0.417 . . . . 0.0 111.688 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -90.5 119.05 30.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.114 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.416 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 60.5 mt -86.4 113.48 22.39 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.757 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 95.7 t -131.9 126.8 57.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.084 0.469 . . . . 0.0 111.285 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.568 ' OE1' ' HA3' ' A' ' 134' ' ' GLY . 0.0 OUTLIER -83.31 141.73 31.6 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 172.777 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -120.04 77.51 1.25 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.374 -174.118 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 2.2 m -78.33 137.49 38.08 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.601 171.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 45.6 mp0 -120.49 -1.36 10.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.74 0.305 . . . . 0.0 110.658 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -94.57 -5.43 45.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.885 0.374 . . . . 0.0 111.297 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ASP . . . . . 0.791 ' O ' ' HA2' ' A' ' 136' ' ' GLY . 4.8 t70 -178.48 -165.01 0.08 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.06 86.2 2.23 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.88 0.371 . . . . 0.0 110.133 175.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.549 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 4.7 t80 -155.13 122.29 5.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.584 -175.607 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.433 ' HZ2' ' HG2' ' A' ' 93' ' ' LYS . 28.8 m95 64.03 20.62 12.28 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.78 0.675 . . . . 0.0 112.513 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.568 ' HA3' ' OE1' ' A' ' 125' ' ' GLU . . . -176.01 -114.85 0.39 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.232 -0.985 . . . . 0.0 112.279 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -112.79 173.14 6.52 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 120.698 0.285 . . . . 0.0 110.794 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' GLY . . . . . 0.791 ' HA2' ' O ' ' A' ' 130' ' ' ASP . . . -120.95 21.11 8.42 Favored Glycine 0 N--CA 1.444 -0.821 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 175.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.6 44.12 4.99 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.425 -0.417 . . . . 0.0 113.26 178.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -174.15 -35.34 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 117.164 0.482 . . . . 0.0 112.207 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 131.01 36.41 0.35 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.893 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt 179.32 89.99 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.816 0.341 . . . . 0.0 110.804 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.589 ' O ' ' HG3' ' A' ' 142' ' ' LYS . . . -123.93 -65.13 0.2 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 119.664 -1.255 . . . . 0.0 112.124 174.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.589 ' HG3' ' O ' ' A' ' 141' ' ' GLY . 47.6 mttp -166.17 79.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 123.697 0.799 . . . . 0.0 109.2 177.214 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -71.1 4.99 2.32 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.511 -173.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.692 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 6.9 tpp180 -49.63 -38.64 32.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.226 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.56 -58.5 7.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.962 -178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.416 ' HA3' ' O ' ' A' ' 123' ' ' LEU . . . -62.49 -29.88 74.8 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.945 -0.645 . . . . 0.0 111.752 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' TYR . . . . . 0.437 ' O ' ' HG2' ' A' ' 151' ' ' GLU . 11.4 t80 -67.21 -40.67 86.45 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.1 mt -61.06 -41.49 96.7 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.895 0.379 . . . . 0.0 110.174 175.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.8 mt -61.15 -36.76 80.64 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.863 177.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 77.8 mtm -77.58 -34.78 53.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.972 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 147' ' ' TYR . 7.3 mm-40 -59.72 -48.26 82.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.457 0.646 . . . . 0.0 109.48 172.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.522 HD11 ' HG3' ' A' ' 102' ' ' ARG . 54.3 tp -64.56 -37.63 88.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.793 179.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.674 ' HG2' HH11 ' A' ' 153' ' ' ARG . 30.9 ttp85 -61.04 -41.34 96.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.988 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -67.28 -33.95 76.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.084 0.468 . . . . 0.0 110.461 176.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -65.32 -53.18 47.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.901 177.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.533 ' HB2' HD21 ' A' ' 116' ' ' LEU . 55.2 mt -68.0 -23.59 65.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.93 -175.029 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.518 ' O ' ' HB3' ' A' ' 160' ' ' LYS . . . -64.43 -48.81 73.92 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.494 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.08 -37.42 80.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.771 0.319 . . . . 0.0 110.616 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.69 -24.19 66.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.019 0.438 . . . . 0.0 110.725 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' A' ' 157' ' ' ALA . 53.3 tttp -68.1 -26.73 65.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.257 176.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.4 mp -78.64 -35.69 45.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.248 0.547 . . . . 0.0 109.935 176.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.435 -178.321 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.7 p . . . . . 0 CA--C 1.535 0.372 0 CA-C-O 121.902 0.858 . . . . 0.0 109.988 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.527 ' HB3' ' CG ' ' A' ' 25' ' ' ASP . 42.3 ttm105 -105.6 37.89 2.12 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.772 0.796 . . . . 0.0 110.195 -176.077 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.419 ' HB1' HD13 ' A' ' 114' ' ' LEU . . . -78.37 29.4 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.2 -176.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 . . . . . 0 C--N 1.326 -0.423 0 CA-C-O 120.785 0.326 . . . . 0.0 110.789 -179.741 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 . . . . . 0 N--CA 1.469 0.493 0 CA-C-O 121.332 0.587 . . . . 0.0 111.588 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.518 HG21 ' HB2' ' A' ' 121' ' ' ALA . 34.4 m -68.59 163.14 3.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.542 176.538 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.428 ' SD ' ' N ' ' A' ' 12' ' ' MET . 0.0 OUTLIER -81.2 -79.9 0.15 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.814 -173.831 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.0 tp60 -171.46 119.74 0.47 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.391 -0.822 . . . . 0.0 108.925 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.8 t70 59.58 88.11 0.08 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.596 0.713 . . . . 0.0 110.198 -172.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.54 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 9.2 m -134.44 117.02 15.82 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.582 -179.128 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.465 ' H ' HD12 ' A' ' 16' ' ' ILE . 4.2 mp -82.95 100.77 6.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.469 HD11 HG11 ' A' ' 11' ' ' VAL . 62.9 mt -89.81 108.75 19.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.266 -177.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.616 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.6 m-20 -92.81 106.64 18.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.598 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.648 ' CE2' ' HB2' ' A' ' 125' ' ' GLU . 39.6 p90 -105.02 151.33 24.08 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 174.034 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.671 ' CE1' ' HA ' ' A' ' 127' ' ' THR . 1.7 t80 -150.1 108.04 3.72 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.436 -0.505 . . . . 0.0 111.923 -176.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.7 m 73.68 171.14 0.3 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.614 0.721 . . . . 0.0 112.247 173.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.0 p -82.43 3.05 29.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.997 -1.001 . . . . 0.0 112.222 -172.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.7 p -76.12 23.39 0.14 Allowed 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -174.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -156.92 163.66 38.9 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 -178.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.527 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 5.7 m-20 -61.24 -35.71 77.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.264 0.554 . . . . 0.0 109.901 175.215 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.426 ' CE1' HD11 ' A' ' 114' ' ' LEU . 92.2 m-85 -77.74 -1.95 33.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.354 177.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.27 -4.15 67.8 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.08 177.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -68.78 -22.85 64.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.423 0.63 . . . . 0.0 110.093 174.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -68.5 -24.86 64.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.475 176.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.0 m -71.98 134.11 45.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.739 175.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -54.97 -23.63 20.14 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -174.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.62 -52.96 17.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 176.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 42.25 -157.2 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.863 0.865 . . . . 0.0 112.992 -176.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -157.86 22.63 0.27 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.737 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.422 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 84.1 m95 -112.99 125.58 29.58 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.935 -177.19 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 24.5 Cg_exo -64.38 143.24 82.04 Favored 'Trans proline' 0 C--O 1.238 0.485 0 C-N-CA 122.844 2.363 . . . . 0.0 112.41 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.652 HG22 ' HA ' ' A' ' 104' ' ' LYS . 32.2 pt -121.92 153.0 25.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.523 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.414 ' HE3' ' O ' ' A' ' 41' ' ' GLY . 37.9 tptt -116.17 95.43 5.08 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 t -107.81 117.42 53.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.291 -178.113 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.6 t70 69.13 5.01 4.84 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.584 0.707 . . . . 0.0 110.632 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.414 ' O ' ' HE3' ' A' ' 38' ' ' LYS . . . 104.67 -2.34 42.18 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.469 -175.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 51.6 mttm -94.25 125.45 38.89 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.66 ' HB ' HH21 ' A' ' 66' ' ' ARG . 35.2 m -82.82 109.72 17.21 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.863 0.363 . . . . 0.0 110.602 178.073 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.436 ' HB2' ' CG1' ' A' ' 37' ' ' ILE . 57.6 m95 -101.84 129.04 27.37 Favored Pre-proline 0 C--N 1.318 -0.773 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 174.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.472 ' CG ' ' HA ' ' A' ' 69' ' ' SER . 52.4 Cg_exo -53.78 -22.57 23.77 Favored 'Trans proline' 0 N--CA 1.475 0.431 0 C-N-CA 123.026 2.484 . . . . 0.0 113.338 -176.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 15.4 t -179.31 173.37 1.12 Allowed 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 175.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.73 -32.57 71.83 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -175.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -50.02 -43.37 50.68 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.559 0.343 . . . . 0.0 111.335 175.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -69.13 -30.13 68.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.168 -175.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -76.02 -31.65 59.0 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -64.02 -52.38 59.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.948 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -63.6 -41.03 98.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.653 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.784 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -67.04 -27.69 67.61 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -100.49 -7.15 24.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.657 0.265 . . . . 0.0 110.988 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.545 ' HA ' ' CZ3' ' A' ' 89' ' ' TRP . 83.2 tttt -62.62 -39.59 94.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.333 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -107.36 160.79 15.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.115 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.754 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.6 pt? -95.73 28.9 2.84 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 168.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -97.68 106.58 18.91 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.105 -1.407 . . . . 0.0 109.895 -176.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 2.4 mp0 -64.69 -35.8 82.2 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.346 -178.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -63.79 -47.6 80.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.797 0.332 . . . . 0.0 110.809 -177.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.552 ' O ' HG12 ' A' ' 65' ' ' ILE . 0.1 OUTLIER -68.77 -29.55 67.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.367 -178.145 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.784 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 38.4 ttm180 -60.99 -41.9 97.38 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.127 0.489 . . . . 0.0 109.754 176.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 45.0 mt-10 -65.7 -39.51 91.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.117 176.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.26 -36.99 63.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.154 -174.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 61' ' ' TYR . 41.1 mm -63.56 -33.47 61.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 174.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.66 HH21 ' HB ' ' A' ' 43' ' ' THR . 0.4 OUTLIER -73.25 -25.31 60.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.271 178.04 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 58.0 mtt-85 -70.28 -33.24 71.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.643 0.259 . . . . 0.0 111.204 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.4 m -92.29 134.88 29.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.239 0.542 . . . . 0.0 111.417 -175.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.472 ' HA ' ' CG ' ' A' ' 45' ' ' PRO . 5.0 p -88.78 -21.32 23.85 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.479 175.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 44.5 t -78.47 126.18 83.42 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.741 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -72.34 -32.29 10.46 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.636 2.224 . . . . 0.0 112.008 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.9 tpt -69.82 -38.36 76.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.266 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 95.5 t -68.32 -39.09 80.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.565 177.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.98 -52.2 57.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.658 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.14 -35.77 74.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.044 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 30.5 ttt85 -62.33 -39.98 94.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.742 0.306 . . . . 0.0 110.689 177.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 72.4 mtm -74.02 -34.93 64.32 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.03 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.49 6.37 77.74 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.469 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -63.25 -42.3 99.16 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -86.95 176.9 7.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.831 0.348 . . . . 0.0 111.482 -170.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -115.18 5.42 14.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.046 -174.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 49.9 m -64.75 -27.3 68.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.884 0.373 . . . . 0.0 111.294 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.498 ' HE3' ' CE2' ' A' ' 61' ' ' TYR . 0.2 OUTLIER -89.49 147.22 37.48 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -50.27 112.55 0.76 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.164 2.576 . . . . 0.0 113.97 -173.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 97.0 mt -88.47 155.17 19.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.023 175.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 -95.76 143.77 26.71 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.747 0.308 . . . . 0.0 110.497 -178.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -79.45 -28.64 41.62 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.177 0.513 . . . . 0.0 110.28 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -85.47 11.9 9.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.621 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.545 ' CZ3' ' HA ' ' A' ' 55' ' ' LYS . 60.7 t-105 -60.39 -19.45 55.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.333 0.587 . . . . 0.0 110.138 176.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.612 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 17.9 mm-40 -68.11 -40.38 82.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.488 175.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.0 p -100.02 -1.0 38.12 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -172.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.484 HG22 ' HA ' ' A' ' 89' ' ' TRP . 34.7 m -112.37 0.8 8.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -177.08 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.612 ' NZ ' ' HA ' ' A' ' 90' ' ' GLU . 50.7 mttp -61.04 -54.92 38.83 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.286 0.565 . . . . 0.0 109.944 179.497 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -67.74 -28.66 67.83 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.471 -178.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -69.94 -54.09 14.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.744 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.4 t -62.22 -43.99 98.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.636 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.09 -50.15 74.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.886 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.5 ttm-85 -60.01 -43.11 95.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.899 0.381 . . . . 0.0 110.866 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -66.48 -48.01 71.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.919 -178.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.11 -37.98 89.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.88 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.425 HD13 ' CD2' ' A' ' 149' ' ' LEU . 90.0 mt -67.5 -43.06 81.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.107 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.522 ' HG3' HD11 ' A' ' 152' ' ' LEU . 10.9 ttt-85 -61.55 -46.55 89.46 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.956 178.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -63.91 -24.48 67.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.097 -179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.652 ' HA ' HG22 ' A' ' 37' ' ' ILE . 28.1 ttpp -76.74 -49.6 15.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.547 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.595 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 77.4 m-85 -71.6 -27.55 63.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.327 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.431 ' HA ' HH11 ' A' ' 112' ' ' ARG . 25.6 mt-10 -73.83 -35.4 64.84 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.613 173.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.538 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 45.3 tp60 -66.81 -34.66 78.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.061 -177.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.447 ' HB3' ' OE2' ' A' ' 110' ' ' GLU . 97.0 m-70 -121.4 109.59 15.06 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.459 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.76 -33.25 73.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.778 -177.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.0 OUTLIER -72.44 -29.9 64.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.77 -179.044 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 76.2 mt -74.61 -38.64 62.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.04 0.447 . . . . 0.0 109.893 175.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.595 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 30.6 ttp-105 -62.89 -43.53 98.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.045 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.69 72.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.722 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.426 HD11 ' CE1' ' A' ' 26' ' ' TYR . 66.4 tp -66.27 -48.17 71.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.943 0.401 . . . . 0.0 110.257 176.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.495 HD23 HD12 ' A' ' 156' ' ' LEU . 42.7 tp -59.41 -44.89 92.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.013 178.449 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 51.3 mt -74.94 -15.96 60.66 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.476 -177.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.3 -21.14 56.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.894 0.378 . . . . 0.0 110.752 176.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.417 ' O ' ' HB3' ' A' ' 121' ' ' ALA . 43.8 p -85.97 -5.95 59.13 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 121.05 0.453 . . . . 0.0 110.559 178.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.07 143.21 65.3 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.282 174.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -99.34 46.56 2.36 Favored 'Cis proline' 0 N--CA 1.456 -0.687 0 C-N-CA 124.397 -1.085 . . . . 0.0 113.56 -0.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.54 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -78.73 176.53 9.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.588 0.232 . . . . 0.0 110.761 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.413 ' HG3' ' SD ' ' A' ' 150' ' ' MET . 35.1 ttpt -108.69 127.82 54.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.271 -176.23 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 27.8 mt -93.16 120.46 33.48 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.27 -172.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 99.0 t -139.42 120.3 15.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.047 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.648 ' HB2' ' CE2' ' A' ' 19' ' ' PHE . 31.8 tt0 -93.88 129.86 40.15 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 172.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.501 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 8.4 t60 -97.63 77.6 2.58 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -176.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.671 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -77.17 92.22 3.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.065 -179.859 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.421 ' HB2' ' HD2' ' A' ' 126' ' ' HIS . 20.3 tt0 -95.53 -15.01 23.16 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.225 -174.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -88.61 -34.08 17.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.542 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ASP . . . . . 0.543 ' O ' ' HB ' ' A' ' 127' ' ' THR . 34.3 t70 -142.19 110.28 5.93 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.101 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.524 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -79.09 85.94 4.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.919 -172.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.518 ' CE2' ' HD3' ' A' ' 142' ' ' LYS . 7.4 t80 -169.55 147.36 3.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.522 172.378 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.456 ' HB3' HD22 ' A' ' 145' ' ' LEU . 18.5 m95 68.53 13.6 8.97 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 123.746 0.654 . . . . 0.0 111.693 178.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -160.44 -155.59 7.83 Favored Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 119.929 -1.129 . . . . 0.0 112.71 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.501 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 15.3 t70 -66.43 -29.02 69.07 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.224 0.535 . . . . 0.0 110.696 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' GLY . . . . . 0.638 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 78.06 0.41 76.2 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.62 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.441 ' HA2' ' NE2' ' A' ' 126' ' ' HIS . . . 88.26 9.37 70.13 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.491 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -170.3 25.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 111.186 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 86.54 -51.97 4.41 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.288 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -88.67 65.25 7.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.3 0.572 . . . . 0.0 111.119 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.638 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -123.32 14.49 8.25 Favored Glycine 0 C--N 1.315 -0.616 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.379 173.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.518 ' HD3' ' CE2' ' A' ' 132' ' ' TYR . 22.2 mtpp 61.36 79.9 0.24 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.211 0.604 . . . . 0.0 111.071 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -75.38 5.33 5.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.276 -176.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.668 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 1.2 ttm180 -32.76 -37.42 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.43 1.092 . . . . 0.0 112.665 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.456 HD22 ' HB3' ' A' ' 133' ' ' TRP . 45.4 tp -61.37 -52.65 63.76 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.611 0.243 . . . . 0.0 111.126 -178.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -63.17 -27.01 69.88 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.701 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -71.33 -43.34 67.2 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.668 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 75.1 mt -61.71 -41.21 97.3 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 175.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.425 ' CD2' HD13 ' A' ' 101' ' ' LEU . 60.8 mt -61.3 -38.83 88.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.813 175.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.413 ' SD ' ' HG3' ' A' ' 122' ' ' LYS . 62.4 mtm -70.09 -38.95 75.82 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.212 178.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.0 -46.13 90.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.026 0.441 . . . . 0.0 109.887 174.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.522 HD11 ' HG3' ' A' ' 102' ' ' ARG . 45.7 tp -63.29 -42.06 99.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.642 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.938 HH11 ' HB3' ' A' ' 153' ' ' ARG . 1.0 OUTLIER -60.01 -42.49 94.39 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.672 176.856 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.63 -44.68 93.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.226 0.536 . . . . 0.0 109.858 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -65.12 -41.42 94.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.143 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.495 HD12 HD23 ' A' ' 115' ' ' LEU . 79.3 mt -76.28 -22.57 54.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.706 -0.225 . . . . 0.0 110.569 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -67.24 -44.37 79.63 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 172.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 75.2 mt -63.6 -40.12 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.876 174.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -63.52 -32.42 73.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.217 177.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -74.58 -44.07 52.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.795 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.12 -16.93 49.68 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.641 175.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.544 177.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.466 HG21 ' HB3' ' A' ' 110' ' ' GLU . 8.4 p . . . . . 0 N--CA 1.469 0.511 0 CA-C-O 122.285 1.041 . . . . 0.0 113.187 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -101.66 -31.91 10.58 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.889 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 56.0 68.79 0.81 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.513 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.432 178.604 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 120.693 0.282 . . . . 0.0 111.523 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.801 HG21 ' HD2' ' A' ' 120' ' ' PRO . 9.0 m -89.65 163.83 2.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.393 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 21.0 mtm -125.26 18.19 8.31 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.594 0.235 . . . . 0.0 110.791 -174.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.401 ' C ' ' H ' ' A' ' 15' ' ' THR . 90.6 mt-30 69.18 -60.21 0.46 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.168 -176.305 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -79.23 24.33 0.34 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.705 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.401 ' H ' ' C ' ' A' ' 13' ' ' GLN . 11.8 m -83.13 103.25 12.4 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.311 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.556 HG12 ' HB3' ' A' ' 122' ' ' LYS . 28.4 mt -100.88 108.73 23.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 175.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -92.35 111.6 24.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.413 -174.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.63 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 16.8 m120 -99.61 116.46 31.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.076 -178.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.455 ' O ' ' HG3' ' A' ' 125' ' ' GLU . 28.8 p90 -112.36 174.44 5.88 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.238 178.414 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -142.16 100.57 3.75 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.094 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.7 p 49.17 -144.39 0.46 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 123.778 0.674 . . . . 0.0 110.967 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.67 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 17.0 p -76.01 -77.16 0.14 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.45 -179.264 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.8 m 68.16 -61.09 0.4 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.107 0.563 . . . . 0.0 112.163 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.406 ' CG ' ' H ' ' A' ' 25' ' ' ASP . 9.5 t70 -132.04 -164.7 1.49 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -175.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.406 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 28.3 t70 -71.25 -20.05 62.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.458 0.647 . . . . 0.0 110.242 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -77.77 -5.66 51.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.505 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.67 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -71.28 -0.85 39.32 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.892 -0.595 . . . . 0.0 114.026 -174.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.41 -24.48 60.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.011 0.434 . . . . 0.0 111.658 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.401 ' HD2' HD23 ' A' ' 149' ' ' LEU . 69.8 m-85 -66.1 -13.3 59.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.431 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.2 t -86.56 131.78 34.08 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 174.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -75.5 8.7 2.64 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -176.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -98.52 4.2 48.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.366 0.603 . . . . 0.0 109.636 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.402 ' O ' HG22 ' A' ' 46' ' ' THR . . . -71.14 138.0 49.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.474 177.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.428 ' HA ' ' CG2' ' A' ' 46' ' ' THR . . . -86.35 60.65 6.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.18 0.514 . . . . 0.0 111.613 -173.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -101.95 113.05 65.97 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.12 175.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.84 132.83 44.41 Favored 'Trans proline' 0 C--O 1.239 0.531 0 C-N-CA 122.776 2.318 . . . . 0.0 112.35 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.511 HG13 ' HB2' ' A' ' 44' ' ' TRP . 12.4 pt -126.11 130.34 72.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.523 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -86.78 98.68 11.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.417 177.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.0 t -126.16 129.13 72.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.97 -174.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 59.68 20.63 9.31 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.812 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 108.46 -14.26 35.89 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.584 -0.817 . . . . 0.0 113.551 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.407 ' HD2' ' HA ' ' A' ' 42' ' ' LYS . 12.6 tptm -124.79 161.84 25.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 117.938 0.869 . . . . 0.0 110.922 -172.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.5 m -96.71 115.44 27.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.898 0.38 . . . . 0.0 110.604 -177.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.511 ' HB2' HG13 ' A' ' 37' ' ' ILE . 67.4 m95 -96.65 129.33 33.25 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.688 178.211 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 27.3 Cg_exo -64.43 -25.61 63.34 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 123.185 2.59 . . . . 0.0 113.082 -176.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.428 ' CG2' ' HA ' ' A' ' 34' ' ' ALA . 0.9 OUTLIER -155.38 162.05 40.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.092 -178.566 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.2 m -66.15 -36.93 84.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.591 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -23.1 62.62 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -175.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -62.94 -45.14 93.88 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.88 0.371 . . . . 0.0 110.461 175.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -70.1 -41.99 73.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.509 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -59.61 -44.31 93.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.662 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.647 ' HG3' ' HA3' ' A' ' 78' ' ' GLY . 0.0 OUTLIER -69.53 -36.16 76.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.691 0.282 . . . . 0.0 110.95 -179.857 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.424 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -70.17 -39.06 75.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.925 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -81.53 -18.93 43.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.871 0.367 . . . . 0.0 110.733 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -59.7 -31.63 69.77 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.027 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.448 ' CE1' ' HA2' ' A' ' 78' ' ' GLY . 88.8 m-85 -95.71 132.38 40.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.772 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 84' ' ' PRO . 0.5 OUTLIER -88.93 0.85 56.25 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.443 0.64 . . . . 0.0 109.681 170.639 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -84.96 111.04 19.33 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 170.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.575 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 40.5 mt-10 -77.31 -10.87 59.7 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.714 -172.1 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -73.57 -45.01 55.89 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -66.21 -38.26 87.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.58 172.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.424 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.2 ttp180 -61.03 -38.41 86.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.653 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.575 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 48.9 mm-40 -60.72 -48.15 83.08 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.386 174.331 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.18 -49.56 76.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.835 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 74.7 mt -64.15 -27.8 43.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.556 -176.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 66' ' ' ARG . 41.3 ttp-105 -77.11 -23.73 51.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.735 0.303 . . . . 0.0 111.259 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 23.8 mtm180 -93.71 -14.64 26.1 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -174.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.0 m -85.75 131.44 34.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.246 0.546 . . . . 0.0 111.069 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.1 t -87.97 -7.11 57.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.751 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.447 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.5 m -87.59 116.05 64.86 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.252 -177.078 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 16.9 Cg_exo -69.03 -51.41 0.45 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.037 2.492 . . . . 0.0 112.551 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 86.2 mtp -63.02 -38.62 91.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 111.044 -175.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 61.1 t -64.59 -39.07 84.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.486 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -51.05 55.17 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.643 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -57.91 -39.77 78.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.56 -178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -65.71 -53.72 37.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.68 0.276 . . . . 0.0 111.234 -177.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -76.14 -18.96 58.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.937 0.399 . . . . 0.0 110.699 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.647 ' HA3' ' HG3' ' A' ' 52' ' ' GLN . . . -83.22 -21.58 58.54 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.753 -0.737 . . . . 0.0 111.98 178.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.6 ttm105 -73.35 -9.22 58.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.149 0.5 . . . . 0.0 110.437 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.623 ' OD1' ' HG2' ' A' ' 83' ' ' LYS . 10.2 t70 -51.92 131.95 31.64 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.154 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.597 ' HD3' ' O ' ' A' ' 81' ' ' ARG . 4.5 tmt_? -112.46 -7.42 13.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.184 0.516 . . . . 0.0 110.073 -177.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.2 m -79.87 -19.02 49.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.189 0.518 . . . . 0.0 110.272 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.623 ' HG2' ' OD1' ' A' ' 80' ' ' ASP . 42.5 mmtm -75.1 161.94 75.26 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.375 176.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.537 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 32.0 Cg_endo -64.36 115.21 3.04 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.231 1.954 . . . . 0.0 111.991 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.426 HD11 ' HG2' ' A' ' 81' ' ' ARG . 96.0 mt -90.0 166.96 13.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.021 178.192 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -86.0 142.81 28.5 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -178.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -58.54 -48.5 80.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.397 . . . . 0.0 110.834 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -96.44 32.87 1.9 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.985 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.5 ' O ' ' HB2' ' A' ' 93' ' ' LYS . 19.2 t-105 -55.67 -44.08 76.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.028 -178.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.16 -18.94 64.0 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.007 0.432 . . . . 0.0 111.33 -177.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.0 m -90.14 -43.37 10.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.666 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.406 ' O ' HG23 ' A' ' 96' ' ' VAL . 33.2 m -79.16 -17.25 13.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.621 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.5 ' HB2' ' O ' ' A' ' 89' ' ' TRP . 21.4 tttp -50.49 -50.16 53.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.458 0.647 . . . . 0.0 110.279 176.038 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.464 ' H ' ' HG2' ' A' ' 94' ' ' GLU . 3.4 mm-40 -63.28 -38.23 90.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.676 -178.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -79.74 -42.2 25.08 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.515 -173.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 92' ' ' VAL . 94.7 t -61.62 -41.76 91.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.871 0.367 . . . . 0.0 110.115 177.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 49.0 tpp -62.44 -45.48 92.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.397 177.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 98' ' ' ARG . 17.2 ttm180 -63.85 -38.13 89.96 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.8 178.632 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -61.79 -44.99 95.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.76 0.314 . . . . 0.0 110.395 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.79 -44.98 79.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.723 177.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.403 HD13 HD12 ' A' ' 149' ' ' LEU . 75.7 mt -59.52 -49.54 77.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.194 178.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -59.77 -48.56 81.2 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.557 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.88 -39.07 73.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.958 0.409 . . . . 0.0 110.629 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.81 -46.4 58.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.253 -175.206 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -82.02 -38.53 24.89 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -76.97 -33.93 57.61 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 122.086 -0.384 . . . . 0.0 111.577 -173.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -83.83 -2.8 57.12 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.141 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.407 ' HB3' ' HG ' ' A' ' 111' ' ' LEU . 65.7 m-70 -126.4 100.25 6.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.463 177.105 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.4 -32.0 66.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.89 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.466 ' HB3' HG21 ' A' ' 3' ' ' VAL . 1.4 mp0 -56.64 -50.6 71.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.089 177.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.407 ' HG ' ' HB3' ' A' ' 108' ' ' HIS . 22.3 mt -76.73 -31.47 57.16 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.509 -173.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -59.15 -44.41 92.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.959 175.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.97 -46.85 89.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.655 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 56.5 tp -59.19 -47.81 83.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.848 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.433 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 48.9 tp -62.47 -50.58 70.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.479 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.539 HD11 ' HB2' ' A' ' 156' ' ' LEU . 10.6 mp -70.95 -13.33 61.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.918 -175.464 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.83 -22.78 60.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.762 -0.199 . . . . 0.0 111.241 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 47.5 p -78.72 -29.99 45.66 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.561 -177.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.497 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -51.29 136.57 30.46 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.801 ' HD2' HG21 ' A' ' 11' ' ' VAL . 85.4 Cg_endo -101.39 42.57 3.19 Favored 'Cis proline' 0 CA--C 1.537 0.642 0 C-N-CA 124.757 -0.934 . . . . 0.0 113.152 -3.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.98 159.11 34.37 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 122.167 -0.333 . . . . 0.0 110.973 178.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.556 ' HB3' HG12 ' A' ' 16' ' ' ILE . 35.5 ttmt -89.49 121.09 31.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.836 0.35 . . . . 0.0 110.487 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.404 HD12 ' HB3' ' A' ' 149' ' ' LEU . 70.1 mt -89.67 108.82 19.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.718 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.63 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 96.1 t -137.91 117.31 14.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.523 -179.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 19' ' ' PHE . 44.9 tt0 -89.4 110.62 21.41 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 173.124 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.484 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 86.1 t60 -82.44 77.33 9.23 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 98.8 m -92.05 99.14 12.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 174.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.457 ' HG3' ' HA3' ' A' ' 137' ' ' GLY . 19.7 tt0 -79.37 -15.94 57.07 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.139 -171.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.409 ' O ' ' HB2' ' A' ' 130' ' ' ASP . 91.3 m-20 -101.68 112.27 24.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.329 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 129' ' ' ASN . 23.8 m-20 72.84 110.19 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.119 0.887 . . . . 0.0 111.392 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.448 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -86.42 94.15 9.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.83 -179.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -159.73 111.08 2.0 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 51.5 m95 70.08 8.13 6.53 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.392 0.677 . . . . 0.0 111.322 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -125.61 -160.48 10.68 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.484 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 0.8 OUTLIER -89.89 -14.08 35.01 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 118.257 1.028 . . . . 0.0 109.768 177.425 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 69.22 17.52 72.21 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.21 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.468 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 90.11 9.33 65.69 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 121.048 -0.596 . . . . 0.0 113.514 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -160.98 -37.75 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 117.593 0.696 . . . . 0.0 112.716 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 147.78 -48.54 0.63 Allowed Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.716 -179.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -76.11 58.68 1.24 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.58 0.705 . . . . 0.0 110.403 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.448 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -125.51 15.23 7.18 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 174.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.442 ' C ' ' H ' ' A' ' 144' ' ' ARG . 55.4 mttm 68.99 55.92 0.42 Allowed 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.732 -0.734 . . . . 0.0 111.411 -174.362 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -68.91 4.9 1.29 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.544 0.688 . . . . 0.0 109.747 173.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 0.0 OUTLIER -52.89 -17.3 1.33 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.174 176.156 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 55.7 tp -58.56 -58.34 8.97 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 169.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.622 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -59.77 -30.7 69.8 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.831 175.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -67.07 -40.8 87.09 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 177.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 89.0 mt -67.87 -33.92 75.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.901 0.381 . . . . 0.0 110.228 176.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.404 ' HB3' HD12 ' A' ' 123' ' ' LEU . 8.2 mp -59.62 -41.65 90.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.839 172.428 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.622 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 53.7 mtt -61.55 -52.0 66.27 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 175.117 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -47.69 -54.27 12.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.332 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 56.7 tp -68.93 -39.98 79.28 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.211 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.433 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 59.8 ttp180 -58.3 -50.31 74.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.814 -177.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 154' ' ' GLU . . . . . 0.617 ' HG2' ' O ' ' A' ' 150' ' ' MET . 14.7 mm-40 -59.98 -46.41 89.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.132 0.491 . . . . 0.0 110.177 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -59.53 -41.33 89.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.705 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.539 ' HB2' HD11 ' A' ' 116' ' ' LEU . 87.3 mt -77.17 -31.54 55.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.788 0.328 . . . . 0.0 110.846 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -64.27 -44.71 90.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.138 -179.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 154' ' ' GLU . 83.9 mt -57.25 -40.46 73.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.282 -179.019 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -80.14 -7.94 59.17 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.424 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -82.82 -26.93 31.25 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.27 -16.65 63.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.881 172.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.572 -178.773 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.4 t . . . . . 0 N--CA 1.45 -0.44 0 CA-C-O 121.32 0.581 . . . . 0.0 110.544 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -77.24 81.47 3.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.584 176.13 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.595 ' HA ' HD13 ' A' ' 114' ' ' LEU . . . -60.45 -56.1 25.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.56 -178.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 . . . . . 0 C--N 1.321 -0.636 0 CA-C-O 121.295 0.569 . . . . 0.0 110.943 -177.063 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.412 ' C ' ' H ' ' A' ' 12' ' ' MET . 2.1 m80 . . . . . 0 N--CA 1.452 -0.325 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.7 m -74.97 10.6 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.884 174.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.465 ' HB2' ' OG1' ' A' ' 15' ' ' THR . 57.3 mtm 69.09 -160.59 0.18 Allowed 'General case' 0 C--O 1.232 0.157 0 O-C-N 123.858 0.724 . . . . 0.0 109.9 -179.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -127.72 141.91 51.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -177.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 59.82 27.73 17.09 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.339 0.59 . . . . 0.0 110.713 -177.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.465 ' OG1' ' HB2' ' A' ' 12' ' ' MET . 96.8 m -92.7 124.09 36.46 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.168 -177.065 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mp -100.03 116.42 43.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.431 176.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 61.2 mt -89.86 96.73 6.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.416 0.627 . . . . 0.0 109.458 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -101.04 130.1 47.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.003 -177.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.0 p90 -132.1 177.33 7.65 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.091 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.51 103.99 5.02 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.419 177.271 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.1 m 63.02 -155.5 0.33 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.153 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.657 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 17.4 p -74.13 -16.0 61.02 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -177.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 m 47.67 -94.99 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 O-C-N 123.809 0.693 . . . . 0.0 111.34 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -162.46 115.27 1.69 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.581 174.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.1 t70 68.48 -68.95 0.16 Allowed 'General case' 0 N--CA 1.47 0.565 0 O-C-N 124.069 0.855 . . . . 0.0 112.321 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -78.37 -1.43 33.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.528 0.68 . . . . 0.0 111.087 -175.174 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.657 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -74.36 -0.24 56.91 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.361 175.756 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -46.27 -28.45 1.29 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.05 0.94 . . . . 0.0 112.955 -176.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -53.58 -38.69 64.16 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.583 0.23 . . . . 0.0 111.584 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 10.9 t -61.82 143.89 55.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.197 0.522 . . . . 0.0 110.819 -176.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -65.26 -31.57 72.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.001 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -77.51 9.99 2.92 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.303 0.573 . . . . 0.0 110.924 -176.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.78 142.56 46.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.661 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.55 62.23 4.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.592 0.71 . . . . 0.0 111.103 -175.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.447 ' CZ2' HD21 ' A' ' 111' ' ' LEU . 86.3 m95 -105.75 102.49 38.82 Favored Pre-proline 0 C--N 1.315 -0.895 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.041 173.797 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -56.91 131.0 42.83 Favored 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 122.903 2.402 . . . . 0.0 112.117 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.518 HG13 ' HB2' ' A' ' 44' ' ' TRP . 18.3 pt -122.32 126.33 74.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.501 0.667 . . . . 0.0 111.248 -178.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -88.17 103.24 15.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 175.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.402 ' HB ' ' CD1' ' A' ' 44' ' ' TRP . 21.8 t -127.43 125.32 65.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.826 -174.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 62.42 23.72 14.08 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.787 0.679 . . . . 0.0 111.209 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.61 13.25 76.23 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.31 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.667 ' HD2' ' HD3' ' A' ' 66' ' ' ARG . 71.7 mmtt -117.46 154.62 31.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 m -105.19 106.28 16.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.828 0.347 . . . . 0.0 110.462 179.373 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.518 ' HB2' HG13 ' A' ' 37' ' ' ILE . 32.8 m95 -105.13 121.46 46.35 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -59.11 -34.5 98.73 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.735 2.29 . . . . 0.0 112.768 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.8 p -146.4 165.38 29.52 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -179.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.85 -28.99 69.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.793 0.33 . . . . 0.0 111.438 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 7.6 mp0 -64.78 -28.55 69.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.632 -178.264 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.403 ' HB3' ' HE3' ' A' ' 44' ' ' TRP . 36.3 m80 -64.7 -47.06 79.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.471 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -70.87 -35.72 72.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.388 0.613 . . . . 0.0 109.608 177.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -58.51 -41.77 86.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.834 177.356 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.662 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 68.3 mm-40 -74.37 -46.65 39.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.414 178.029 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.93 -38.63 76.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.986 -176.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -84.14 -24.5 30.21 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.542 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.661 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.1 ttmp? -60.01 -42.6 94.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.154 0.502 . . . . 0.0 110.242 172.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.433 ' HD1' ' O ' ' A' ' 52' ' ' GLN . 21.8 m-85 -77.37 135.07 38.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.327 178.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.753 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.4 pt? -97.63 12.79 32.39 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.339 0.59 . . . . 0.0 109.484 175.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -98.5 128.52 44.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.91 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -69.94 -35.35 74.46 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -175.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -67.76 -36.92 81.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.849 0.357 . . . . 0.0 110.33 -178.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.406 ' O ' HG13 ' A' ' 65' ' ' ILE . 6.9 m-85 -77.79 -28.18 50.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.944 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 54.6 ttp85 -59.06 -51.8 68.49 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.036 0.446 . . . . 0.0 110.208 175.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -75.57 -19.38 59.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -69.12 -46.31 67.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.211 0.529 . . . . 0.0 110.184 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.608 HG21 ' HB2' ' A' ' 52' ' ' GLN . 68.7 mt -72.95 -19.63 18.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.396 0.617 . . . . 0.0 110.12 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.667 ' HD3' ' HD2' ' A' ' 42' ' ' LYS . 12.6 ttp180 -72.72 -28.17 62.5 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.324 170.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -78.36 -41.97 31.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.253 -176.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.504 HG21 ' HB ' ' A' ' 73' ' ' VAL . 8.4 p -65.28 121.38 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.562 0.696 . . . . 0.0 111.672 -175.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.8 m -77.32 -42.28 37.36 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.422 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.401 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 47.4 t -70.59 127.42 91.98 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.239 -176.008 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 19.7 Cg_exo -66.61 -30.69 42.25 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.799 2.333 . . . . 0.0 111.924 176.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.2 mmt -70.19 -37.88 75.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.134 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.504 ' HB ' HG21 ' A' ' 68' ' ' VAL . 47.4 t -71.99 -32.22 43.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.091 0.472 . . . . 0.0 110.078 177.342 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.09 -39.84 93.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.22 173.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.88 -34.72 79.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.05 175.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -61.5 -33.15 73.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.122 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 25.6 mmt -61.77 -50.84 70.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.563 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.14 -26.05 62.74 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.833 -178.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 79' ' ' ARG . 2.6 tpt180 -84.47 -0.22 52.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.932 0.396 . . . . 0.0 110.326 -178.413 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.02 -31.45 71.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.022 -177.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 75.6 -46.24 0.56 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.95 175.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.5 m -82.59 40.17 0.65 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.306 0.574 . . . . 0.0 111.189 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.407 ' HB3' ' CE2' ' A' ' 56' ' ' PHE . 44.8 mmtm -123.24 151.67 62.65 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.139 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.35 105.17 1.68 Allowed 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.286 1.991 . . . . 0.0 112.909 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.42 HD22 ' HD3' ' A' ' 55' ' ' LYS . 54.2 mt -86.8 145.32 26.66 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 174.146 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.588 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . 8.0 ptp180 -74.17 164.53 26.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.245 0.545 . . . . 0.0 111.934 -175.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tptt -67.68 -40.75 84.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.708 -172.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.415 ' O ' HG22 ' A' ' 92' ' ' VAL . 10.3 m120 -101.34 23.48 10.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.429 -172.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.402 ' CZ2' ' HE3' ' A' ' 55' ' ' LYS . 38.7 t-105 -58.69 -47.1 85.68 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -175.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -59.35 -29.21 67.5 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -175.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.4 p -90.29 -22.6 21.5 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -176.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 88' ' ' ASN . 31.1 m -108.24 -5.92 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -176.095 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -49.11 -53.64 19.75 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.095 0.474 . . . . 0.0 111.614 -178.172 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -71.02 -29.98 66.05 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.52 -178.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -71.35 -42.39 68.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.934 -178.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 79.6 t -60.41 -46.62 94.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.104 0.478 . . . . 0.0 110.218 176.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.439 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 52.6 ttm -64.85 -42.21 95.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.756 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -65.8 -33.5 76.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.731 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.42 -45.12 77.05 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.03 0.443 . . . . 0.0 110.154 175.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.45 98.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.607 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 97' ' ' MET . 95.0 mt -66.04 -32.59 74.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.85 177.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.569 ' HG2' HD11 ' A' ' 152' ' ' LEU . 1.9 tmm_? -64.88 -44.26 90.22 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -69.06 -32.66 72.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.031 0.443 . . . . 0.0 110.669 176.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -63.71 -47.98 78.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.106 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.426 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 56.8 m-85 -85.6 -43.3 13.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.1 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -69.36 -43.71 73.02 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.538 -174.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 99.4 mt-30 -80.1 -1.36 39.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.899 0.38 . . . . 0.0 111.44 -175.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -122.95 96.42 5.01 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 170.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -53.74 -38.19 64.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.945 -171.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -57.74 -45.8 85.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 178.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.447 HD21 ' CZ2' ' A' ' 35' ' ' TRP . 34.6 mt -68.72 -42.45 77.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.249 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.604 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 49.4 ttp85 -59.53 -45.21 92.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.551 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.57 -42.49 98.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.709 178.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.595 HD13 ' HA ' ' A' ' 5' ' ' ALA . 50.3 tp -61.71 -48.87 78.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.619 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 153' ' ' ARG . 47.8 tp -56.93 -43.56 81.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.906 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.855 HD23 ' HG2' ' A' ' 153' ' ' ARG . 47.9 mt -68.7 -35.04 76.67 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.168 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.15 -15.1 60.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -176.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 33.7 p -82.06 -21.42 36.88 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 120.199 -0.601 . . . . 0.0 111.913 -176.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.52 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -64.01 148.18 95.5 Favored Pre-proline 0 C--O 1.234 0.247 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.492 174.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -94.5 32.67 10.68 Favored 'Cis proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.906 -1.289 . . . . 0.0 113.544 1.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.31 140.91 48.81 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 176.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -85.79 119.93 26.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.539 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 40.6 mt -80.15 122.78 27.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.499 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 80.4 t -132.48 114.67 23.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.189 0.519 . . . . 0.0 112.123 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -77.99 115.77 17.98 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 167.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.566 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 59.9 t60 -87.8 77.23 8.62 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.739 -173.1 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.606 ' OG1' ' HA3' ' A' ' 134' ' ' GLY . 1.0 OUTLIER -77.33 96.75 4.69 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.779 -179.588 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -93.86 -16.03 24.47 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.796 -175.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -66.97 -43.92 81.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.493 176.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -163.25 152.96 15.32 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -178.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.19 85.64 5.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.405 0.621 . . . . 0.0 110.044 178.167 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.508 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 37.5 t80 -149.32 106.21 3.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.566 -176.195 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.612 ' H ' ' HB3' ' A' ' 142' ' ' LYS . 66.9 m95 65.74 10.06 6.49 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.652 -176.621 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.606 ' HA3' ' OG1' ' A' ' 127' ' ' THR . . . -131.26 -161.12 10.12 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.57 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.566 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 4.0 p-10 -91.42 -6.58 52.57 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.754 0.311 . . . . 0.0 111.301 -176.009 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 76.35 7.11 84.83 Favored Glycine 0 N--CA 1.454 -0.155 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.037 177.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.447 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 82.04 40.05 10.87 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.938 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -179.35 -25.91 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.343 0.257 . . . . 0.0 111.6 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' GLY . . . . . 0.438 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 132.37 -16.31 4.9 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 119.881 -1.152 . . . . 0.0 113.776 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -133.39 82.11 1.97 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 117.315 0.558 . . . . 0.0 110.459 -177.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.39 -60.91 0.19 Allowed Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.246 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.612 ' HB3' ' H ' ' A' ' 133' ' ' TRP . 1.7 ttmp? -175.48 48.87 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -65.76 5.11 0.5 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.003 -0.998 . . . . 0.0 112.735 -171.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.544 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 30.8 ttm180 -54.84 -22.45 14.58 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.405 ' HB2' ' HB3' ' A' ' 133' ' ' TRP . 66.5 tp -61.48 -59.03 5.87 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.715 0.293 . . . . 0.0 110.345 174.458 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.428 ' HA2' HD12 ' A' ' 149' ' ' LEU . . . -61.95 -31.58 79.02 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.567 176.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 147' ' ' TYR . . . . . 0.441 ' HB3' ' HA ' ' A' ' 144' ' ' ARG . 56.8 t80 -61.68 -43.91 97.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.529 -0.336 . . . . 0.0 110.137 176.369 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 94.0 mt -66.9 -36.37 82.14 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.76 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.428 HD12 ' HA2' ' A' ' 146' ' ' GLY . 97.5 mt -60.76 -44.65 96.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.554 177.534 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 73.2 mtm -74.26 -34.59 63.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.875 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.04 -49.63 77.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.486 0.66 . . . . 0.0 109.619 175.166 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.569 HD11 ' HG2' ' A' ' 102' ' ' ARG . 55.5 tp -65.5 -34.63 78.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.076 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.855 ' HG2' HD23 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -59.12 -40.09 84.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.449 -179.362 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 154' ' ' GLU . . . . . 0.449 ' O ' HG13 ' A' ' 158' ' ' ILE . 13.7 mm-40 -64.71 -39.04 92.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.501 177.041 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -64.5 -43.67 93.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.088 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.531 ' HB2' HD21 ' A' ' 116' ' ' LEU . 89.1 mt -69.84 -31.13 68.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.888 0.375 . . . . 0.0 110.496 -177.667 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.88 -36.29 81.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.353 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 154' ' ' GLU . 97.4 mt -68.3 -42.72 84.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.62 178.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.71 -37.8 85.44 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.023 177.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -64.4 -35.54 81.25 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 7.2 tp -64.53 -29.52 70.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.379 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.78 -179.273 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 51.4 t . . . . . 0 N--CA 1.452 -0.362 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -87.76 81.63 7.56 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.564 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.25 34.86 0.57 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.527 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.882 -177.223 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.1 m -85.98 159.01 3.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.979 0.419 . . . . 0.0 110.317 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.1 mtm -93.14 18.75 8.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.929 -176.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 65.78 115.8 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.311 -178.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.8 t70 52.48 66.54 1.19 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.608 0.718 . . . . 0.0 110.802 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -117.15 150.52 38.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.687 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.506 HG13 ' HD2' ' A' ' 122' ' ' LYS . 3.5 mp -98.73 107.58 20.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 120.973 0.416 . . . . 0.0 110.089 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.2 mt -90.78 111.05 23.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.946 0.403 . . . . 0.0 110.711 -178.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.463 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 4.6 m-20 -90.79 104.44 17.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.774 176.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -100.76 137.28 39.35 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.774 0.321 . . . . 0.0 110.458 -178.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.431 ' O ' ' HB3' ' A' ' 21' ' ' SER . 5.1 t80 -150.54 169.9 20.42 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.876 175.654 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.445 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 39.9 t 75.64 109.28 0.07 Allowed 'General case' 0 C--O 1.231 0.099 0 O-C-N 123.924 0.765 . . . . 0.0 111.721 175.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 p -81.17 2.54 27.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.388 176.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -91.57 -4.68 55.1 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.223 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -107.88 165.87 11.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.722 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -77.1 -15.11 59.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.923 -175.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -101.22 -1.55 33.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.916 0.389 . . . . 0.0 111.07 176.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' A' ' 21' ' ' SER . . . -75.74 0.16 62.22 Favored Glycine 0 C--O 1.229 -0.214 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.906 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -57.51 -32.95 67.54 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -63.14 -21.35 66.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.596 -177.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 75.7 m -68.05 144.26 55.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.254 0.549 . . . . 0.0 111.052 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -67.78 -20.2 65.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.86 -176.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -95.06 10.89 34.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.941 0.401 . . . . 0.0 110.9 -177.463 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.43 140.17 58.09 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.85 0.357 . . . . 0.0 111.286 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.531 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -86.08 59.43 5.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.94 -177.428 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 50.3 m95 -118.9 116.09 34.55 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.729 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 28.4 Cg_exo -61.59 128.16 23.84 Favored 'Trans proline' 0 C--O 1.238 0.52 0 C-N-CA 123.098 2.532 . . . . 0.0 112.413 -178.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.528 HG22 ' HA ' ' A' ' 104' ' ' LYS . 16.4 pt -112.31 133.7 57.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.891 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -93.95 105.07 17.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.693 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.2 t -123.88 118.94 55.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.996 -175.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 58.62 27.86 16.34 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.631 0.582 . . . . 0.0 111.428 176.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.44 -7.96 66.38 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.131 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -114.67 135.68 53.89 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 122.209 -0.583 . . . . 0.0 110.802 -177.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.5 m -95.4 106.44 18.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.92 -175.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 65.6 m95 -91.38 128.83 45.41 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.795 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.44 -35.55 85.28 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.087 2.524 . . . . 0.0 113.412 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.531 HG22 ' HA ' ' A' ' 34' ' ' ALA . 65.4 p -148.84 165.25 32.06 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 9.3 m -56.83 -41.56 78.09 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.285 0.366 . . . . 0.0 110.703 177.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.787 ' O ' ' HB2' ' A' ' 52' ' ' GLN . 10.0 tp10 -73.65 -1.13 17.68 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.735 -177.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.428 ' NE2' HG13 ' A' ' 68' ' ' VAL . 18.1 m80 -85.03 -40.61 16.65 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 120.984 -1.073 . . . . 0.0 109.47 171.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -74.16 -35.97 64.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.274 0.559 . . . . 0.0 109.573 174.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.558 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 37.8 t80 -72.03 -31.29 66.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.495 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.787 ' HB2' ' O ' ' A' ' 48' ' ' GLU . 3.8 tp-100 -71.73 -45.74 60.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.297 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.92 -37.31 84.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.146 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -88.42 -8.23 55.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.348 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.618 ' HG3' ' CZ2' ' A' ' 89' ' ' TRP . 4.9 ttmp? -69.46 -30.48 68.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.329 0.585 . . . . 0.0 109.936 175.143 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.49 ' CE2' ' HA2' ' A' ' 78' ' ' GLY . 91.3 m-85 -116.4 175.88 5.36 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.291 -178.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.28 7.23 9.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.792 178.62 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.781 ' HB2' ' HB2' ' A' ' 61' ' ' TYR . 27.9 m-20 -76.0 126.45 31.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.823 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.452 ' HG3' ' H ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -64.02 -36.52 84.26 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.49 175.942 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 64' ' ' GLU . 35.9 mmtm -65.18 -48.29 73.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.567 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.781 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -63.02 -45.75 90.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.154 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -54.74 -42.79 72.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.66 178.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.546 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 27.5 mt-10 -69.48 -40.64 76.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.355 178.426 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 6.0 mm-40 -63.77 -44.44 93.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.832 0.348 . . . . 0.0 111.319 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.664 HG21 ' HB3' ' A' ' 52' ' ' GLN . 74.7 mt -67.27 -26.13 35.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.358 0.599 . . . . 0.0 110.675 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 66' ' ' ARG . 0.0 OUTLIER -77.15 -14.99 59.7 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.92 174.984 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 84.8 mtp180 -96.15 -4.64 42.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.378 -178.061 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.428 HG13 ' NE2' ' A' ' 49' ' ' HIS . 10.0 p -110.35 132.54 58.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.047 0.451 . . . . 0.0 111.651 -174.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -93.66 -36.83 12.15 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.438 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 2.5 m -63.13 117.17 30.63 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.993 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 21.8 Cg_exo -65.36 -42.06 14.13 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.854 2.369 . . . . 0.0 112.79 -176.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.4 tpt -65.0 -36.15 83.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.098 -175.367 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 98.4 t -63.97 -44.01 97.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-O 120.928 0.394 . . . . 0.0 110.357 178.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.84 98.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.484 178.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.411 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -61.53 -41.64 97.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.05 178.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.64 -48.3 82.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.282 -179.412 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.6 ptp -71.61 -22.77 61.67 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.821 -178.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.49 ' HA2' ' CE2' ' A' ' 56' ' ' PHE . . . -77.88 -20.19 73.91 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.634 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.3 mtp85 -86.47 38.73 0.8 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.034 0.445 . . . . 0.0 111.396 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -111.05 109.6 19.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.5 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 81' ' ' ARG . 7.2 tpt180 -90.92 0.79 57.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.499 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.9 m -66.74 -37.84 85.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.035 -176.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.448 ' HD2' ' CE1' ' A' ' 56' ' ' PHE . 9.3 ptpp? -85.26 155.04 60.36 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.796 -178.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.63 117.74 5.26 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.329 2.019 . . . . 0.0 112.123 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.12 174.88 7.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.062 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.66 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 63.1 mtp180 -71.09 143.03 50.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.611 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -47.71 -44.6 27.79 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.174 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -118.01 27.03 9.25 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.474 -175.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.66 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 29.5 t-105 -58.69 -43.4 89.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.97 -15.86 60.22 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.11 -178.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 8.0 m -98.73 -48.89 4.78 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.903 0.382 . . . . 0.0 111.191 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.448 ' O ' HG23 ' A' ' 96' ' ' VAL . 33.4 m -76.69 -8.69 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.478 -176.132 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.462 ' HG2' ' HZ2' ' A' ' 133' ' ' TRP . 35.9 ttmt -48.63 -53.98 16.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.743 -179.105 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -69.88 -23.42 63.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.224 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -76.27 -42.92 43.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.962 0.411 . . . . 0.0 110.24 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 92' ' ' VAL . 87.7 t -60.56 -49.84 82.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.029 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 48.6 ttm -69.4 -33.19 72.64 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.991 -178.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 98' ' ' ARG . 14.2 ttm-85 -62.39 -41.65 98.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.769 0.319 . . . . 0.0 110.167 178.538 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -68.09 -39.31 82.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.617 178.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.64 -46.46 89.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.571 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 96.3 mt -63.9 -39.34 93.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.721 177.295 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 102' ' ' ARG . 21.5 ttt180 -58.62 -46.99 85.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.04 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.73 -33.16 73.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.884 178.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.528 ' HA ' HG22 ' A' ' 37' ' ' ILE . 61.2 tttp -56.28 -59.35 5.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.268 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.535 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 89.3 m-85 -82.49 -9.69 59.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.167 -176.356 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -87.95 -35.4 17.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.958 0.408 . . . . 0.0 110.721 177.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -77.17 -47.68 19.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.384 -177.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -92.88 108.44 20.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.705 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.16 -29.76 70.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.122 176.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.418 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.4 mp0 -55.94 -48.2 76.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.88 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 47.9 mt -74.51 -36.62 63.21 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.433 -176.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.535 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 25.5 ttm180 -59.53 -45.09 92.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.633 176.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.82 -39.41 94.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.587 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 tp -66.17 -44.36 84.27 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.551 177.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.417 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 53.6 tp -60.39 -51.94 67.35 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.302 179.369 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.456 HD21 ' HA ' ' A' ' 157' ' ' ALA . 11.0 mp -67.09 -23.09 65.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.595 -177.181 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -68.43 -22.6 64.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.596 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 44.9 p -71.08 -35.96 72.07 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 116.73 -0.213 . . . . 0.0 111.078 -178.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -49.31 135.86 16.44 Favored Pre-proline 0 N--CA 1.464 0.249 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.47 -179.262 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.5 Cg_endo -99.55 48.31 1.99 Allowed 'Cis proline' 0 CA--C 1.536 0.604 0 C-N-CA 124.184 -1.173 . . . . 0.0 113.495 0.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -88.5 160.32 17.55 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.811 0.338 . . . . 0.0 111.497 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.506 ' HD2' HG13 ' A' ' 16' ' ' ILE . 46.4 mttp -86.18 146.34 26.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.939 178.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.8 mt -108.53 112.71 25.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.144 177.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 98.6 t -128.97 124.5 61.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.875 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -86.84 117.34 25.51 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.415 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 7.1 t60 -98.24 80.1 2.63 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.427 -170.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.2 t -103.15 162.19 13.17 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 171.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -138.92 15.24 2.67 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.818 0.818 . . . . 0.0 109.81 177.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -81.77 -26.23 34.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.124 173.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -173.95 -174.15 0.9 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.607 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.46 ' HB1' ' HA3' ' A' ' 141' ' ' GLY . . . -135.32 85.6 2.18 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 175.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.497 ' C ' ' H ' ' A' ' 134' ' ' GLY . 13.1 t80 -149.13 116.45 6.11 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.462 ' HZ2' ' HG2' ' A' ' 93' ' ' LYS . 83.3 m95 74.04 -35.69 0.31 Allowed 'General case' 0 N--CA 1.477 0.919 0 O-C-N 123.908 0.755 . . . . 0.0 109.783 -169.046 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.497 ' H ' ' C ' ' A' ' 132' ' ' TYR . . . -117.63 -172.94 16.12 Favored Glycine 0 N--CA 1.43 -1.706 0 N-CA-C 108.184 -1.966 . . . . 0.0 108.184 177.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.62 ' HB2' ' HB2' ' A' ' 143' ' ' ASN . 0.8 OUTLIER -111.88 168.52 9.52 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 118.935 -1.106 . . . . 0.0 111.615 -175.863 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -79.18 36.24 1.96 Allowed Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.449 ' H ' ' C ' ' A' ' 135' ' ' ASP . . . 88.26 -14.75 58.5 Favored Glycine 0 CA--C 1.523 0.547 0 CA-C-N 114.935 -0.632 . . . . 0.0 114.329 177.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -111.89 -53.66 2.69 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 118.202 1.001 . . . . 0.0 113.601 -171.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 130.54 53.24 0.1 OUTLIER Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.346 -0.931 . . . . 0.0 112.479 -175.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.436 ' H ' ' CG ' ' A' ' 135' ' ' ASP . 60.8 tttp -172.92 37.43 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.208 0.528 . . . . 0.0 110.155 -178.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.46 ' HA3' ' HB1' ' A' ' 131' ' ' ALA . . . -123.42 -65.28 0.21 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 120.095 -1.05 . . . . 0.0 113.217 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.494 ' C ' ' H ' ' A' ' 144' ' ' ARG . 48.4 tttp -173.2 25.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 117.255 0.527 . . . . 0.0 112.211 175.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' ASN . . . . . 0.62 ' HB2' ' HB2' ' A' ' 135' ' ' ASP . 9.9 t30 -51.54 5.65 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.19 1.396 . . . . 0.0 114.166 173.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.494 ' H ' ' C ' ' A' ' 142' ' ' LYS . 9.9 tpt180 -45.57 -21.02 0.08 Allowed 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 22.9 tp -57.58 -45.76 84.83 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.891 0.377 . . . . 0.0 110.496 174.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -62.64 -31.46 80.04 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.701 -0.559 . . . . 0.0 111.701 178.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -66.8 -39.76 87.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 175.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 70.1 mt -63.61 -42.56 98.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.953 176.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 98.8 mt -60.71 -45.52 93.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.831 178.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.553 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 71.5 mtm -67.25 -39.05 86.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.96 178.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -61.86 -45.38 94.01 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.126 0.489 . . . . 0.0 110.306 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 67.6 tp -64.58 -39.11 93.15 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.658 177.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.417 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 59.8 ttp180 -56.59 -49.8 73.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.314 177.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 154' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 150' ' ' MET . 14.1 mm-40 -62.13 -36.27 81.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.603 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -62.23 -56.13 21.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.313 176.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.491 HD22 ' NH2' ' A' ' 112' ' ' ARG . 37.3 mt -68.89 -25.14 64.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.098 -173.273 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -62.68 -52.39 63.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.107 173.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 73.0 mt -73.0 -38.26 55.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.794 -179.046 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -57.33 -47.39 81.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.477 177.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -79.61 -14.4 58.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.101 179.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 161' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 18.5 tp -76.76 -20.52 56.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.169 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 . . . . . 0 CA--C 1.53 0.174 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.869 177.996 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.9 p . . . . . 0 CA--C 1.528 0.121 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.9 mtm105 62.41 83.53 0.15 Allowed 'General case' 0 C--N 1.342 0.254 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.141 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.27 76.46 8.39 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.37 -176.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--N 1.323 -0.546 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.752 175.143 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 . . . . . 0 N--CA 1.464 0.243 0 CA-C-O 121.447 0.642 . . . . 0.0 111.72 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 m -84.75 16.18 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.991 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 43.3 mtm 66.77 -100.43 0.06 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.746 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 179.37 148.21 0.24 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 62.51 10.38 3.99 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 123.421 0.45 . . . . 0.0 111.603 177.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.1 m -83.35 114.36 21.37 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.302 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 51.6 mt -96.68 114.08 32.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.777 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.7 mt -93.21 109.97 22.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.433 -175.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -96.41 103.56 15.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.763 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -109.15 127.11 53.92 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.234 -176.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -150.55 100.59 2.87 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.66 170.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 m 161.89 101.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.209 1.404 . . . . 0.0 108.291 -177.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.53 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 10.2 p -79.46 -55.4 5.08 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.646 0.26 . . . . 0.0 111.376 -176.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m 56.65 -95.35 0.05 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.676 -176.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -178.2 21.03 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.094 0.473 . . . . 0.0 110.576 178.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.9 p30 -136.97 -90.95 0.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -86.41 -4.95 59.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.57 0.7 . . . . 0.0 110.182 -173.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.53 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -73.31 -0.02 50.65 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.223 -0.898 . . . . 0.0 112.945 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.464 ' HA ' ' CB ' ' A' ' 33' ' ' ALA . 34.5 t70 -54.54 -23.57 17.16 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -176.675 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -64.88 -29.11 70.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.599 178.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.1 t -77.6 143.47 38.26 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -62.04 -30.91 71.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.934 0.397 . . . . 0.0 110.824 -174.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.515 ' HB3' HG21 ' A' ' 22' ' ' THR . 16.7 t80 -75.47 11.53 1.24 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.416 -173.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.464 ' CB ' ' HA ' ' A' ' 28' ' ' ASP . . . -73.83 106.0 5.36 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 175.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.525 ' HA ' ' HB ' ' A' ' 46' ' ' THR . . . -74.32 59.93 0.81 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.624 0.726 . . . . 0.0 112.522 -171.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 62.0 m95 -93.67 125.54 53.17 Favored Pre-proline 0 C--N 1.312 -1.06 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.742 172.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.55 125.37 17.17 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 122.678 2.252 . . . . 0.0 112.042 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.666 HG22 ' HA ' ' A' ' 104' ' ' LYS . 15.3 pt -114.99 141.87 30.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.872 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -100.05 100.1 10.93 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.426 HG12 ' OD2' ' A' ' 40' ' ' ASP . 4.5 t -124.04 127.08 73.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.11 -174.204 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD2' HG12 ' A' ' 39' ' ' VAL . 24.6 m-20 63.5 6.7 2.64 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.965 0.791 . . . . 0.0 111.913 176.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 114.02 -3.13 24.14 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.556 -0.83 . . . . 0.0 113.088 177.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -123.15 155.28 37.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.247 0.523 . . . . 0.0 111.065 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.6 m -94.73 119.98 34.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.448 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.487 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 37.9 m95 -109.13 124.21 34.69 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.445 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.612 ' O ' ' HB ' ' A' ' 46' ' ' THR . 4.8 Cg_exo -76.05 48.05 2.16 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.32 2.68 . . . . 0.0 113.683 -175.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.612 ' HB ' ' O ' ' A' ' 45' ' ' PRO . 1.6 t 129.57 160.69 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.5 1.52 . . . . 0.0 109.701 172.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 m -58.77 -38.78 79.25 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 123.563 0.539 . . . . 0.0 111.294 -177.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.438 ' H ' HG23 ' A' ' 46' ' ' THR . 14.1 mp0 -53.11 -43.1 66.61 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.305 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 32.2 m80 -64.53 -39.52 93.92 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.328 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -76.1 -46.5 28.61 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.582 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -60.03 -50.03 75.34 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.578 -178.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.424 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 6.9 tp-100 -64.63 -39.89 94.5 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.662 -177.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.918 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -68.71 -35.45 77.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.598 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -79.62 -16.84 55.1 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.909 0.385 . . . . 0.0 110.333 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.451 ' HE3' ' CD1' ' A' ' 89' ' ' TRP . 79.8 tttt -67.41 -21.8 65.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.793 -178.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.426 ' HZ ' ' CA ' ' A' ' 78' ' ' GLY . 82.2 m-85 -102.21 178.47 4.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.079 0.466 . . . . 0.0 111.901 -175.236 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.421 ' N ' HD12 ' A' ' 57' ' ' LEU . 5.6 mp -111.17 -37.01 5.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.642 -175.379 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.533 ' OD2' ' HB2' ' A' ' 61' ' ' TYR . 1.8 p-10 -75.5 111.65 11.02 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.602 0.715 . . . . 0.0 110.582 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -62.06 -32.85 73.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.658 -1.156 . . . . 0.0 111.791 -174.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.42 -37.9 76.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.105 0.479 . . . . 0.0 109.915 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.533 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . 2.0 t80 -77.06 -33.85 57.16 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.073 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.918 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 32.2 ttp85 -57.73 -44.84 86.3 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.372 0.606 . . . . 0.0 109.803 174.402 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -68.44 -31.57 70.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.233 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -70.14 -33.22 71.53 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.358 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 53' ' ' ALA . 75.2 mt -72.65 -23.19 20.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.005 0.431 . . . . 0.0 110.772 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.455 ' HB2' ' CZ3' ' A' ' 44' ' ' TRP . 55.3 ttp85 -84.33 -20.67 31.66 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.286 0.565 . . . . 0.0 109.637 171.299 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -75.99 -30.55 58.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.143 -177.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.9 p -78.47 129.31 37.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.92 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 43.9 t -77.19 -37.58 53.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.583 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.457 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.9 m -77.18 119.55 77.95 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 -177.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 22.1 Cg_exo -65.2 -37.59 31.24 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.844 2.363 . . . . 0.0 112.401 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.4 tpt -65.35 -41.15 94.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.819 -176.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 94.5 t -60.22 -38.05 75.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.129 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.437 ' HB1' HG23 ' A' ' 65' ' ' ILE . . . -60.81 -58.51 8.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.015 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 79' ' ' ARG . . . -60.98 -37.84 83.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.937 178.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.84 -49.92 73.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.73 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -78.42 -19.28 53.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.867 0.365 . . . . 0.0 110.967 -176.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.426 ' CA ' ' HZ ' ' A' ' 56' ' ' PHE . . . -93.85 0.03 66.82 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.41 176.528 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.459 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 33.1 ttt180 -89.95 -9.93 46.98 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -79.03 164.38 24.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.573 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.451 HH11 ' HD3' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -94.21 -5.99 45.71 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.275 -174.104 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.7 m -72.33 -8.04 52.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.171 0.51 . . . . 0.0 111.299 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -111.71 123.44 34.74 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.033 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.8 119.9 6.86 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.422 2.081 . . . . 0.0 111.185 173.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 59.2 mt -88.87 156.5 18.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.05 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.651 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 67.1 mtt180 -61.85 125.96 25.68 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 176.129 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -54.11 -44.13 71.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.933 -174.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -102.07 27.29 6.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.378 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.651 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 73.7 t-105 -58.15 -44.12 87.7 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.235 179.037 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -61.36 -21.95 64.5 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.591 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.9 m -80.55 -38.05 30.31 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.783 0.325 . . . . 0.0 110.874 177.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.4 m -97.32 1.91 10.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.087 0.47 . . . . 0.0 111.228 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -55.64 29.49 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.964 -178.368 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.82 -28.9 70.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.362 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -70.01 -51.35 32.99 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.795 0.331 . . . . 0.0 110.522 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 87.3 t -62.72 -39.3 84.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.4 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.463 ' HA ' ' CE ' ' A' ' 97' ' ' MET . 3.3 tpt -63.4 -43.21 98.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.203 178.394 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.629 ' HA ' HD11 ' A' ' 148' ' ' LEU . 56.7 ttp180 -61.8 -40.48 95.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.772 179.371 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -65.33 -50.53 65.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.765 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.82 -45.87 87.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.406 -177.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.488 HD12 HD12 ' A' ' 148' ' ' LEU . 35.0 mt -65.17 -37.66 88.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.994 -176.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.649 ' HG3' HD21 ' A' ' 156' ' ' LEU . 31.2 ttp85 -67.67 -36.58 80.98 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.365 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.582 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -66.2 -31.77 72.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.117 0.484 . . . . 0.0 109.989 177.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.666 ' HA ' HG22 ' A' ' 37' ' ' ILE . 59.7 tttm -62.77 -49.35 75.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.886 179.115 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 81.8 m-85 -82.32 -33.32 29.0 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -176.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -75.26 -19.25 59.82 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 121.944 -0.472 . . . . 0.0 111.567 -179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.582 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.0 OUTLIER -86.38 -46.39 10.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.77 0.319 . . . . 0.0 110.242 177.329 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -99.39 100.22 11.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.423 ' HB1' HH21 ' A' ' 112' ' ' ARG . . . -62.29 -31.83 72.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.399 -173.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.489 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.6 pm0 -68.87 -33.87 74.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.666 0.27 . . . . 0.0 110.661 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 57.9 mt -73.19 -35.99 66.48 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 176.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.487 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 28.0 ttp85 -58.17 -48.67 79.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.478 175.124 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.58 -40.03 93.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.593 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.6 tp -61.5 -43.45 98.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.633 178.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 39.5 tp -62.04 -56.42 19.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.629 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.3 mp -66.88 -16.55 64.38 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.991 -0.284 . . . . 0.0 111.5 -176.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -75.96 -13.2 60.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 60.7 p -89.23 -16.44 31.24 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 120.39 -0.524 . . . . 0.0 111.441 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.507 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -55.7 139.41 68.92 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.722 176.097 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -101.26 39.14 4.8 Favored 'Cis proline' 0 CA--C 1.535 0.548 0 C-N-CA 124.295 -1.127 . . . . 0.0 113.492 -1.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.04 153.56 42.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 0.0 111.151 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.525 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 56.3 tttp -86.98 122.98 31.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.035 -178.451 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 42.9 mt -91.2 125.13 35.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.527 -177.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 87.9 t -138.54 138.09 42.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.241 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -107.26 141.98 37.74 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -105.25 77.58 1.31 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.52 0.676 . . . . 0.0 109.612 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.69 86.36 5.3 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.731 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -78.02 -23.72 48.12 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.001 -174.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -83.69 -22.36 32.08 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -175.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -154.69 148.34 25.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.866 0.365 . . . . 0.0 110.824 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.581 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -106.56 87.43 2.53 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.621 -177.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.524 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 3.7 t80 -147.55 -37.75 0.2 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.852 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.571 ' HB3' HD22 ' A' ' 145' ' ' LEU . 7.1 m95 -134.45 32.55 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -176.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -162.21 -128.35 0.94 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 119.66 -1.257 . . . . 0.0 112.374 -177.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.31 -7.98 16.52 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.335 0.588 . . . . 0.0 109.688 174.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 70.69 6.06 58.16 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.539 178.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 83.58 11.4 80.0 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.303 -0.475 . . . . 0.0 112.467 -176.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -164.06 28.22 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.689 0.244 . . . . 0.0 111.14 -177.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 81.18 -51.31 4.34 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.558 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -80.7 58.32 3.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.174 0.511 . . . . 0.0 110.823 -175.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.581 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -123.3 15.26 8.18 Favored Glycine 0 C--N 1.318 -0.461 0 CA-C-N 115.754 -0.657 . . . . 0.0 113.85 -178.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.524 ' HD2' ' HA ' ' A' ' 132' ' ' TYR . 50.3 mttm 69.12 78.47 0.21 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.253 0.549 . . . . 0.0 111.375 178.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -70.06 5.31 1.67 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.335 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -18.62 37.76 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -177.247 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.571 HD22 ' HB3' ' A' ' 133' ' ' TRP . 43.1 tp -65.79 -53.0 46.12 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 118.239 0.472 . . . . 0.0 109.993 175.065 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -58.92 -39.56 94.22 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 177.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -64.69 -44.87 88.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.714 -0.243 . . . . 0.0 110.659 177.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 98' ' ' ARG . 1.7 tm? -60.44 -45.94 91.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 90.5 mt -56.37 -43.46 79.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.157 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.525 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 73.8 mtm -72.46 -43.47 63.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.13 -179.335 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -66.73 -39.5 87.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.988 0.423 . . . . 0.0 110.457 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.502 HD11 ' HB2' ' A' ' 102' ' ' ARG . 55.0 tp -66.47 -37.65 85.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.849 176.252 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.641 ' HG2' HH11 ' A' ' 153' ' ' ARG . 23.3 ttp85 -61.23 -36.11 79.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.397 176.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 154' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 150' ' ' MET . 49.7 mm-40 -58.64 -49.18 78.45 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.035 0.445 . . . . 0.0 110.229 174.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -62.68 -46.01 90.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.831 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.649 HD21 ' HG3' ' A' ' 102' ' ' ARG . 97.8 mt -64.22 -32.96 74.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.752 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.35 -61.32 1.84 Allowed 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.09 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 69.6 mt -58.0 -38.47 67.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -170.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -64.23 -33.36 75.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.024 0.44 . . . . 0.0 111.228 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -94.03 -20.16 20.2 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.574 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 26.0 tp -72.63 -32.95 66.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.68 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 . . . . . 0 C--O 1.234 0.266 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.554 173.291 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.684 HG23 ' HB2' ' A' ' 25' ' ' ASP . 3.4 p . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 55.1 mtt85 -119.87 -36.85 3.2 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.114 -0.235 . . . . 0.0 111.235 -172.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.507 ' HB1' HD13 ' A' ' 114' ' ' LEU . . . 65.63 14.49 9.54 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.811 0.694 . . . . 0.0 110.472 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 . . . . . 0 C--N 1.331 -0.22 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.833 -175.117 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.3 t60 . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.4 m -87.52 -175.14 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.113 -177.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.427 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 10.1 mtt -97.7 -85.41 0.36 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.587 -174.229 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.427 ' H ' ' HB2' ' A' ' 12' ' ' MET . 21.7 pt20 -177.97 114.68 0.08 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.873 179.595 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.9 t70 57.9 31.53 20.7 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.812 0.815 . . . . 0.0 110.289 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.5 m -76.33 146.4 38.85 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.766 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.2 mt -109.01 108.69 25.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.222 0.534 . . . . 0.0 110.516 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.4 mt -89.91 101.81 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.158 -175.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -97.45 101.15 12.62 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.123 172.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -101.19 154.06 19.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.823 -176.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -150.17 164.32 35.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.1 p 54.09 100.61 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.632 0.773 . . . . 0.0 111.843 -177.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -69.02 2.99 2.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.62 -175.007 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.0 p -56.41 -36.72 69.25 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -176.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -92.69 165.52 12.92 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.287 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.684 ' HB2' HG23 ' A' ' 3' ' ' VAL . 6.0 p-10 -82.57 2.17 34.45 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -171.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -101.16 -4.4 27.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.187 0.518 . . . . 0.0 109.851 174.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -93.34 -0.23 67.77 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.682 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.462 ' CG ' HD22 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -58.0 -21.67 45.97 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -173.044 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.467 ' CZ ' ' HG ' ' A' ' 114' ' ' LEU . 97.1 m-85 -55.33 -21.73 16.25 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -177.846 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.531 ' HA ' ' OE2' ' A' ' 125' ' ' GLU . 22.8 t -62.42 141.68 58.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.097 0.475 . . . . 0.0 110.477 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -73.34 -21.38 60.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.751 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -90.81 6.08 45.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.176 0.512 . . . . 0.0 110.29 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.474 ' HB1' ' HD1' ' A' ' 35' ' ' TRP . . . -64.15 137.22 57.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.02 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.459 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -84.7 59.69 5.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.294 0.568 . . . . 0.0 111.136 -176.591 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.564 ' HB2' ' HE2' ' A' ' 104' ' ' LYS . 81.4 m95 -112.18 113.36 51.75 Favored Pre-proline 0 C--N 1.318 -0.796 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.882 176.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.58 125.65 19.73 Favored 'Trans proline' 0 C--O 1.237 0.475 0 C-N-CA 123.289 2.659 . . . . 0.0 112.785 -176.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.669 HG22 ' HA ' ' A' ' 104' ' ' LYS . 26.9 pt -115.95 146.44 20.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.681 179.115 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -109.72 103.32 12.13 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.4 t -122.77 124.06 69.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.705 -175.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 59.62 24.93 13.77 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 123.805 0.691 . . . . 0.0 111.085 178.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.27 -4.02 82.46 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.881 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -104.44 138.56 40.65 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 122.363 -0.492 . . . . 0.0 110.805 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.9 m -90.74 114.31 26.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.454 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.45 ' HB2' HG13 ' A' ' 37' ' ' ILE . 51.3 m95 -108.58 130.62 22.53 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.82 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 21.0 Cg_exo -65.95 -28.83 49.82 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.614 2.209 . . . . 0.0 112.467 -178.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.459 HG22 ' HA ' ' A' ' 34' ' ' ALA . 19.6 p -147.7 162.71 38.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.983 -177.386 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.1 m -66.85 -30.25 70.37 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.037 0.446 . . . . 0.0 110.616 178.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.402 ' OE1' ' HB3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -64.11 -28.99 70.15 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.611 -177.048 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.599 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 28.2 m80 -66.87 -41.81 86.68 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.971 -0.292 . . . . 0.0 110.845 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -70.9 -37.97 73.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.394 0.616 . . . . 0.0 109.511 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.524 ' HA ' HG11 ' A' ' 96' ' ' VAL . 78.3 t80 -61.35 -40.14 93.17 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.489 176.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.531 ' NE2' ' HA ' ' A' ' 75' ' ' ALA . 4.3 tp60 -72.28 -45.32 60.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.652 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.947 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -65.69 -38.91 90.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.168 -177.504 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.37 -16.94 44.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.582 0.215 . . . . 0.0 111.582 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.863 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.8 ttmp? -57.2 -38.39 73.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.156 0.503 . . . . 0.0 110.526 173.43 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -98.93 149.08 23.32 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.337 -178.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.803 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.3 pt? -95.71 1.95 53.71 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.244 0.545 . . . . 0.0 110.065 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -87.79 111.08 20.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.137 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.43 ' OE2' ' HD2' ' A' ' 62' ' ' ARG . 6.9 tp10 -60.43 -33.47 72.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.958 -177.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -62.71 -51.83 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.879 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.45 ' O ' ' HB3' ' A' ' 64' ' ' GLU . 0.5 OUTLIER -66.93 -29.8 69.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.018 0.437 . . . . 0.0 110.418 179.724 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.947 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.4 ttm180 -65.28 -41.32 94.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.122 175.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -62.96 -35.89 81.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.717 175.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 61' ' ' TYR . 11.4 tp10 -60.9 -55.43 33.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.905 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.55 ' O ' HG12 ' A' ' 68' ' ' VAL . 1.8 mp -61.98 -25.95 38.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 120.901 0.382 . . . . 0.0 111.309 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -71.87 -35.78 69.89 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 121.784 -0.572 . . . . 0.0 111.353 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -86.37 -0.03 55.04 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.702 -173.249 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.55 HG12 ' O ' ' A' ' 65' ' ' ILE . 11.9 p -95.59 117.54 39.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.32 0.581 . . . . 0.0 110.02 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.8 m -81.95 -24.97 35.25 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.991 0.424 . . . . 0.0 110.455 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.4 m -77.22 116.45 57.63 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.307 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.599 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 31.5 Cg_exo -59.85 -55.02 1.88 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.192 2.595 . . . . 0.0 113.064 -175.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 18.2 ttt -65.58 -22.84 66.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.498 -172.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 95.7 t -72.59 -37.79 57.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.838 0.351 . . . . 0.0 110.259 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.68 -45.81 92.74 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.051 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.531 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -62.2 -42.58 99.42 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.532 176.021 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -60.06 -55.91 28.08 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.579 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -74.78 -19.29 60.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.836 0.351 . . . . 0.0 111.121 -177.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -93.82 0.18 67.04 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.81 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 46.5 ttt180 -79.47 -0.61 33.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.196 0.522 . . . . 0.0 109.831 175.676 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -75.96 127.79 33.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.912 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.7 ttt180 -98.29 7.8 45.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.693 -175.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.2 m -83.01 -15.45 51.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.23 0.538 . . . . 0.0 110.344 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -79.32 150.24 73.63 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.147 179.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.429 ' HB2' HD21 ' A' ' 57' ' ' LEU . 18.3 Cg_endo -58.23 110.41 0.64 Allowed 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.657 2.238 . . . . 0.0 112.333 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.2 mt -85.99 120.77 27.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.829 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -68.63 134.0 49.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.257 0.551 . . . . 0.0 110.292 -178.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.51 -28.46 64.97 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.447 -170.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -90.88 16.88 8.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.561 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.484 ' CZ3' ' HA ' ' A' ' 55' ' ' LYS . 53.7 t-105 -58.98 -33.37 70.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.301 0.572 . . . . 0.0 109.871 174.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -56.63 -42.13 78.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.255 175.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 m -81.01 -43.34 19.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.69 -175.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.438 HG22 ' HA ' ' A' ' 89' ' ' TRP . 29.6 m -87.45 -3.46 9.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -170.435 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.48 ' HG3' ' N ' ' A' ' 94' ' ' GLU . 6.3 ptpp? -57.36 -36.88 71.78 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.839 0.352 . . . . 0.0 110.764 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.48 ' N ' ' HG3' ' A' ' 93' ' ' LYS . 7.6 pt-20 -78.41 -33.53 48.65 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.135 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -63.1 -43.77 97.57 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 -178.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.524 HG11 ' HA ' ' A' ' 51' ' ' PHE . 54.4 t -64.16 -49.17 82.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.382 176.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 10.1 mmt -61.45 -54.13 47.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.865 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -64.34 -27.09 68.79 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.789 -0.187 . . . . 0.0 111.314 -175.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -77.41 -46.38 22.85 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 176.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.64 -42.06 98.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.738 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 91.5 mt -64.88 -37.42 87.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.705 178.157 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.503 ' HA ' HD21 ' A' ' 152' ' ' LEU . 21.5 ttm-85 -63.46 -45.03 92.7 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 177.342 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.527 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -63.49 -38.37 90.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.781 0.324 . . . . 0.0 110.311 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.669 ' HA ' HG22 ' A' ' 37' ' ' ILE . 15.0 tptp -54.11 -56.3 19.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.499 176.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -80.64 -46.48 15.56 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -175.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.508 ' OE2' HD22 ' A' ' 156' ' ' LEU . 18.2 mm-40 -65.61 -21.56 66.59 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -175.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 35.7 tp60 -79.29 -44.48 21.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.096 0.474 . . . . 0.0 110.506 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 64.5 m-70 -99.54 112.23 24.47 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.924 -176.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -59.39 -32.16 69.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.844 0.354 . . . . 0.0 110.352 178.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.412 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.3 mp0 -58.01 -60.1 4.24 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.034 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.462 HD22 ' CG ' ' A' ' 28' ' ' ASP . 13.0 mt -69.44 -34.47 74.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.497 -175.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 108' ' ' HIS . 18.8 ttt180 -54.86 -54.67 39.41 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.137 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.13 -36.73 80.16 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.565 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.507 HD13 ' HB1' ' A' ' 5' ' ' ALA . 42.9 tp -58.09 -48.5 79.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.803 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.441 HD23 HD12 ' A' ' 156' ' ' LEU . 49.2 tp -58.61 -48.78 79.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.26 178.239 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.527 HD21 ' HB2' ' A' ' 156' ' ' LEU . 33.5 mt -70.16 -18.4 63.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.764 0.316 . . . . 0.0 111.339 -175.635 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -80.74 -14.82 57.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.682 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 72.9 p -73.74 -31.62 63.45 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.297 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.49 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -57.71 136.37 82.82 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.993 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.49 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 72.4 Cg_endo -100.44 72.13 0.16 OUTLIER 'Cis proline' 0 N--CA 1.455 -0.768 0 C-N-CA 124.267 -1.139 . . . . 0.0 113.529 -0.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -110.98 157.59 19.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.842 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.439 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 0.3 OUTLIER -83.58 140.96 31.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.172 176.04 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.479 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 67.7 mt -109.02 114.83 28.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.304 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 42.3 t -129.09 115.9 38.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.153 -177.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.531 ' OE2' ' HA ' ' A' ' 30' ' ' SER . 40.2 tt0 -80.73 133.63 35.7 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 172.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 45.1 t60 -121.75 119.47 31.8 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.194 -175.03 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 13.0 t -121.9 166.45 14.39 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 170.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.49 ' HA ' ' HA3' ' A' ' 137' ' ' GLY . 3.9 mp0 -116.34 4.93 13.48 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.946 173.412 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -124.63 110.97 15.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.524 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 25.7 t70 74.47 112.75 0.07 Allowed 'General case' 0 N--CA 1.465 0.291 0 O-C-N 124.563 1.164 . . . . 0.0 111.867 176.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.664 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -86.39 112.79 21.79 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.964 178.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -155.21 -68.49 0.12 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.452 -176.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.568 ' HB3' HD22 ' A' ' 145' ' ' LEU . 92.1 m95 -110.34 58.18 0.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.414 0.626 . . . . 0.0 109.504 177.321 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 131.31 156.73 8.57 Favored Glycine 0 N--CA 1.442 -0.95 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 -171.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.987 ' HA ' ' HA3' ' A' ' 141' ' ' GLY . 14.2 t0 -54.75 137.34 44.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.769 0.284 . . . . 0.0 111.715 -174.032 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -88.01 31.18 4.79 Favored Glycine 0 C--N 1.333 0.367 0 O-C-N 123.58 0.55 . . . . 0.0 111.988 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.49 ' HA3' ' HA ' ' A' ' 128' ' ' GLU . . . 78.98 54.48 4.12 Favored Glycine 0 C--N 1.317 -0.486 0 CA-C-N 114.838 -0.681 . . . . 0.0 114.076 177.196 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -174.79 -37.11 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 135.09 25.36 0.54 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 120.194 -1.003 . . . . 0.0 112.654 -175.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -156.68 91.01 1.19 Allowed 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.987 ' HA3' ' HA ' ' A' ' 135' ' ' ASP . . . -142.16 1.18 1.65 Allowed Glycine 0 C--N 1.312 -0.776 0 C-N-CA 119.614 -1.279 . . . . 0.0 114.604 -178.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.419 ' C ' ' H ' ' A' ' 144' ' ' ARG . 24.5 mtmm 65.29 88.96 0.1 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.634 0.73 . . . . 0.0 110.37 -176.549 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -67.56 5.21 0.84 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.378 178.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.604 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 5.9 mmt180 -54.09 -24.74 18.62 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.467 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.568 HD22 ' HB3' ' A' ' 133' ' ' TRP . 52.1 tp -65.89 -52.96 45.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.106 0.479 . . . . 0.0 109.893 175.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 123' ' ' LEU . . . -66.21 -28.3 73.59 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.658 176.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -64.71 -37.74 88.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.008 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 91.9 mt -69.8 -35.91 75.23 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.374 175.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.473 HD12 ' HA2' ' A' ' 146' ' ' GLY . 95.7 mt -61.59 -44.68 96.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.185 176.188 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.551 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 74.3 mtm -72.74 -30.95 64.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.782 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -62.32 -54.2 44.04 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.503 HD21 ' HA ' ' A' ' 102' ' ' ARG . 56.6 tp -61.25 -39.3 89.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.847 178.5 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -53.0 -55.32 24.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.045 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' GLU . . . . . 0.551 ' HG2' ' O ' ' A' ' 150' ' ' MET . 11.4 mm-40 -62.36 -39.19 92.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.222 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -61.18 -45.66 93.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.507 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.684 ' O ' ' HG2' ' A' ' 160' ' ' LYS . 87.2 mt -64.55 -44.78 89.68 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.458 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.18 -51.47 68.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.165 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 154' ' ' GLU . 82.1 mt -55.78 -40.98 64.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 O-C-N 123.072 0.232 . . . . 0.0 110.632 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.2 -47.9 84.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.686 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' LYS . . . . . 0.684 ' HG2' ' O ' ' A' ' 156' ' ' LEU . 46.6 mmtm -67.13 -35.23 79.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.739 -177.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.48 -23.23 65.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.513 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 . . . . . 0 C--N 1.324 -0.508 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -175.918 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 121.095 0.474 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 72.9 mtm180 -115.66 11.36 15.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.556 -176.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.22 -25.29 65.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.45 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.582 -177.668 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 p-80 . . . . . 0 CA--C 1.52 -0.183 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 31.7 m -104.36 176.66 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 120.661 0.267 . . . . 0.0 110.675 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.43 ' N ' ' SD ' ' A' ' 12' ' ' MET . 0.2 OUTLIER -99.93 -96.68 0.25 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.801 -174.164 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -146.65 116.27 7.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.286 -177.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 48.11 36.84 7.03 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 123.708 0.63 . . . . 0.0 111.917 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.2 m -76.32 125.08 28.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.805 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.689 HG13 ' HD3' ' A' ' 122' ' ' LYS . 2.2 mp -85.49 116.77 29.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 174.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.0 mt -96.71 98.43 7.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.956 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.515 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 23.1 m120 -86.74 101.48 13.34 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 177.097 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.499 ' O ' ' HA ' ' A' ' 125' ' ' GLU . 49.7 p90 -103.8 146.48 28.56 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 177.371 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -150.34 141.58 23.2 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.503 -177.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 96.0 p 60.18 119.72 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.656 1.222 . . . . 0.0 112.358 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.777 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 0.6 OUTLIER -55.44 -64.66 0.77 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.931 178.61 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.3 m 45.87 -95.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.848 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -160.74 34.47 0.15 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 122.059 0.933 . . . . 0.0 108.556 -177.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -126.35 -145.29 0.32 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.167 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.18 -1.42 15.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.424 178.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.777 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -60.64 -0.15 1.24 Allowed Glycine 0 CA--C 1.525 0.697 0 CA-C-N 115.787 -0.642 . . . . 0.0 114.524 -178.112 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -55.12 -25.48 31.98 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.011 0.905 . . . . 0.0 111.073 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -65.51 -36.95 85.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.763 174.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.0 m -57.32 145.69 31.38 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.511 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -81.22 10.85 4.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.868 -175.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -105.48 6.27 32.25 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.49 0.662 . . . . 0.0 109.481 175.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.519 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -71.43 141.92 50.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.635 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.62 52.53 1.91 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.101 0.477 . . . . 0.0 111.616 -176.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -108.26 106.65 59.04 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.957 177.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -56.48 139.57 87.54 Favored 'Trans proline' 0 C--O 1.238 0.522 0 C-N-CA 123.064 2.509 . . . . 0.0 112.547 -178.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.509 HG13 ' HB2' ' A' ' 44' ' ' TRP . 24.7 pt -119.98 131.66 71.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.746 -178.166 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -96.62 93.56 6.82 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 44.5 t -102.66 123.61 56.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.85 -176.154 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 58.99 24.29 12.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.329 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 97.09 3.88 58.82 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.711 176.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.465 ' HD3' ' HA ' ' A' ' 42' ' ' LYS . 25.0 mmtp -128.01 152.12 48.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.133 0.966 . . . . 0.0 111.822 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.0 m -91.63 113.83 26.2 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.557 -171.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.509 ' HB2' HG13 ' A' ' 37' ' ' ILE . 63.4 m95 -101.29 128.53 29.06 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 172.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.55 -39.02 90.25 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.933 2.422 . . . . 0.0 112.521 -176.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.82 171.28 17.97 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.066 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.8 m -69.86 -43.33 72.11 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -172.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.628 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -62.5 -31.7 72.5 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -175.76 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.489 ' HE2' HG13 ' A' ' 68' ' ' VAL . 19.7 m80 -55.06 -41.85 71.99 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.459 ' CE2' HG13 ' A' ' 96' ' ' VAL . 55.2 t80 -73.07 -40.63 64.89 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.276 178.102 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.481 ' HA ' HG11 ' A' ' 96' ' ' VAL . 54.2 t80 -61.92 -51.74 66.91 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.977 -179.429 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.628 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 11.3 mm100 -62.35 -40.09 95.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.946 -177.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.484 ' HB1' ' HB2' ' A' ' 62' ' ' ARG . . . -66.95 -27.6 67.6 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.155 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -84.38 -19.83 32.94 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.542 -177.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -64.28 -52.62 57.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.981 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.556 ' HE1' ' HG3' ' A' ' 83' ' ' LYS . 84.9 m-85 -69.85 153.1 43.76 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -169.373 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.447 ' N ' HD12 ' A' ' 57' ' ' LEU . 6.0 mp -97.94 -1.45 42.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.883 173.039 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.666 ' HB2' ' HB2' ' A' ' 61' ' ' TYR . 5.8 m-20 -86.8 110.78 20.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.524 176.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -60.56 -36.46 78.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.116 0.484 . . . . 0.0 109.882 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -62.36 -41.38 98.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.7 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.666 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 1.8 m-85 -64.81 -44.8 88.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.319 -0.4 . . . . 0.0 112.006 -175.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.484 ' HB2' ' HB1' ' A' ' 53' ' ' ALA . 5.1 ptp85 -66.75 -31.16 71.63 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.951 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -70.15 -35.88 74.36 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 174.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -64.7 -40.73 95.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.866 176.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.56 ' HA ' HG12 ' A' ' 68' ' ' VAL . 72.5 mt -71.88 -20.65 20.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.212 0.53 . . . . 0.0 110.525 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -77.7 -10.13 59.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.108 0.48 . . . . 0.0 110.44 173.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -110.75 -28.53 8.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.294 -178.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' A' ' 65' ' ' ILE . 13.5 p -62.64 121.38 11.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.53 0.681 . . . . 0.0 111.315 -176.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.1 m -85.09 -12.68 52.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.159 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.403 ' H ' HG22 ' A' ' 68' ' ' VAL . 26.1 t -102.23 124.04 41.12 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.056 -177.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.96 -34.45 59.41 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.897 2.398 . . . . 0.0 111.99 177.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 85.2 mmm -66.41 -37.47 85.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.179 -177.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 94.9 t -68.1 -41.23 84.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.539 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.26 91.63 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.37 177.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.466 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -59.61 -42.28 92.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.859 176.697 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -60.8 -45.11 95.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.021 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 66.8 mtt -57.47 -51.1 70.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.303 0.573 . . . . 0.0 110.728 178.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.492 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -73.23 -14.25 79.21 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.783 -177.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -73.32 -31.34 63.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.68 0.276 . . . . 0.0 110.534 -178.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -64.92 138.01 58.11 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.044 0.45 . . . . 0.0 111.384 -177.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.439 HH11 ' HD2' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.54 4.64 28.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.639 -177.04 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.1 m -83.44 -31.98 26.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 0.0 110.06 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.556 ' HG3' ' HE1' ' A' ' 56' ' ' PHE . 32.2 mmmt -65.14 146.88 98.86 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.862 177.263 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 32.4 Cg_exo -59.57 148.07 88.97 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.929 2.42 . . . . 0.0 112.598 178.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 98.2 mt -112.39 159.72 18.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.33 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.7 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 54.4 mtp180 -83.29 153.24 24.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.374 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.13 -34.06 75.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.883 0.373 . . . . 0.0 110.627 179.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.441 ' O ' HG22 ' A' ' 92' ' ' VAL . 10.5 p30 -100.87 12.95 36.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.31 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.7 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 55.0 t-105 -65.81 -17.56 64.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.145 0.498 . . . . 0.0 109.758 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -65.26 -39.48 92.68 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.341 176.673 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.0 p -99.17 -42.49 7.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.465 ' O ' HG23 ' A' ' 96' ' ' VAL . 32.6 m -67.96 -14.03 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -167.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.639 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 35.2 mtmm -51.87 -44.25 63.63 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.096 0.474 . . . . 0.0 111.131 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -80.46 -25.36 38.93 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.624 -175.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.445 ' OE1' ' HA ' ' A' ' 92' ' ' VAL . 1.7 mp0 -70.87 -40.68 72.14 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 174.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.481 HG11 ' HA ' ' A' ' 51' ' ' PHE . 84.3 t -63.96 -48.75 84.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.772 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.3 ttm -70.43 -30.67 67.59 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.303 -178.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.1 ttm-85 -63.9 -38.0 89.46 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -65.22 -42.82 93.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.627 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.91 -48.28 81.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.786 178.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.2 mt -62.46 -46.7 87.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.074 178.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.507 ' HA ' HD21 ' A' ' 152' ' ' LEU . 49.8 ttt85 -59.14 -51.98 67.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.555 -178.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -62.78 -29.85 71.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 0.0 111.151 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.509 ' HA ' HG22 ' A' ' 37' ' ' ILE . 88.3 tttt -64.2 -53.65 45.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.821 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 86.2 m-85 -77.69 -22.95 49.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.88 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.431 ' OE1' ' HG2' ' A' ' 102' ' ' ARG . 44.3 mt-10 -72.34 -49.88 30.96 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.128 -0.358 . . . . 0.0 110.917 175.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.2 OUTLIER -71.68 -26.03 62.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.893 -175.918 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -116.52 101.93 9.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.908 0.385 . . . . 0.0 110.111 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.13 75.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.816 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.4 pm0 -69.41 -30.52 68.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.805 0.336 . . . . 0.0 110.621 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 29.2 mt -74.59 -37.51 62.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.775 ' HG3' HD13 ' A' ' 156' ' ' LEU . 16.5 ttm180 -64.17 -44.29 92.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.924 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.93 -43.91 97.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.375 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.1 tp -57.68 -48.42 79.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.809 176.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.412 HD23 HD12 ' A' ' 156' ' ' LEU . 43.4 tp -57.65 -44.83 85.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.845 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.49 HD21 ' HB2' ' A' ' 156' ' ' LEU . 78.8 mt -69.5 -29.52 67.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.539 -178.582 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -70.31 -17.34 63.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.705 -178.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 47.5 p -72.61 -35.63 67.89 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.745 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -50.92 133.44 29.2 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.824 -179.047 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 48.4 Cg_endo -100.55 38.65 5.21 Favored 'Cis proline' 0 CA--C 1.535 0.574 0 C-N-CA 124.184 -1.173 . . . . 0.0 113.432 1.068 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -75.1 157.96 33.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.288 0.566 . . . . 0.0 111.099 178.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.689 ' HD3' HG13 ' A' ' 16' ' ' ILE . 86.7 tttt -95.39 122.8 38.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.264 -173.23 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.3 mt -90.27 119.27 30.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.787 0.327 . . . . 0.0 111.216 -175.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.515 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 60.5 t -136.75 119.36 20.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.731 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.499 ' HA ' ' O ' ' A' ' 19' ' ' PHE . 37.7 tt0 -97.38 116.94 30.54 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 171.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.556 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 1.3 t60 -87.1 77.11 9.18 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.354 -170.129 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 17.1 m -86.37 107.7 18.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.105 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.9 -28.5 11.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.61 -178.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -55.89 -42.44 75.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.52 177.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -140.42 136.18 32.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.432 -177.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -100.41 87.51 3.42 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.925 0.393 . . . . 0.0 110.844 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -146.55 -45.29 0.19 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.592 ' HB3' HD22 ' A' ' 145' ' ' LEU . 85.9 m95 -131.2 107.27 8.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.434 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 129.15 -149.77 18.65 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.031 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.556 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 3.8 m-20 -73.03 -28.83 62.57 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.97 0.414 . . . . 0.0 111.646 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 70.16 10.17 65.06 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 110.209 -1.156 . . . . 0.0 110.209 -168.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 92.29 -12.51 69.48 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 114.826 -0.687 . . . . 0.0 113.537 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 22.2 p-80 -144.45 0.75 1.03 Allowed 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -174.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 111.28 -50.49 0.77 Allowed Glycine 0 CA--C 1.517 0.196 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.619 178.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -81.45 61.31 4.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.706 0.765 . . . . 0.0 109.955 178.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -132.13 15.21 5.08 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.777 176.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt 70.44 79.61 0.18 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.326 0.584 . . . . 0.0 111.865 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -77.72 5.42 9.4 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.755 0.788 . . . . 0.0 110.12 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.637 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 46.1 mtm105 -62.98 -8.19 6.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.878 -177.276 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.592 HD22 ' HB3' ' A' ' 133' ' ' TRP . 66.5 tp -66.61 -49.09 67.44 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 168.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -59.09 -37.89 92.28 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 173.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' TYR . . . . . 0.41 ' HB3' ' HA ' ' A' ' 144' ' ' ARG . 88.2 t80 -63.75 -45.81 88.18 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.581 -0.31 . . . . 0.0 110.911 176.326 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 87.9 mt -56.77 -41.4 77.58 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.887 0.375 . . . . 0.0 110.399 178.132 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.96 -45.88 91.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.947 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.565 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 75.3 mtm -71.64 -36.57 70.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.235 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -62.81 -49.17 75.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.531 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.507 HD21 ' HA ' ' A' ' 102' ' ' ARG . 48.9 tp -66.16 -34.16 77.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.259 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 150' ' ' MET . 62.1 ttp180 -54.4 -48.81 71.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.693 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 154' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 150' ' ' MET . 5.7 mm-40 -59.96 -39.71 86.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.504 -178.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.78 -39.87 95.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.537 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.775 HD13 ' HG3' ' A' ' 112' ' ' ARG . 87.8 mt -78.29 -15.09 59.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.958 -178.574 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.419 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -79.69 -45.57 18.74 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 174.681 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 154' ' ' GLU . 63.5 mt -60.66 -29.28 44.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.104 177.446 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 159' ' ' GLU . . . . . 0.455 ' HB3' ' O ' ' A' ' 156' ' ' LEU . 5.5 tt0 -47.9 -53.83 14.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.408 174.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -80.71 -10.83 59.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.621 -174.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 161' ' ' LEU . . . . . 0.419 HD13 ' O ' ' A' ' 157' ' ' ALA . 8.2 mp -74.66 -22.01 59.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.022 0.439 . . . . 0.0 110.254 175.057 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.732 -179.986 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.3 t . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.597 0.237 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 44.4 mtm180 -115.44 97.2 6.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.314 -176.007 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.84 94.83 1.08 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 172.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.215 -174.234 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 . . . . . 0 N--CA 1.453 -0.309 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.8 m -77.98 165.18 3.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.379 0.609 . . . . 0.0 111.291 176.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.732 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 13.8 mtt -95.39 50.42 1.24 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.047 -174.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 61.31 -94.88 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.886 -174.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -115.4 74.79 0.9 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.679 0.752 . . . . 0.0 109.317 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.732 ' HB ' ' HB2' ' A' ' 12' ' ' MET . 7.0 t -94.35 154.73 17.34 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.6 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.562 HG12 ' HB2' ' A' ' 122' ' ' LYS . 58.3 mt -111.1 123.6 67.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.029 0.443 . . . . 0.0 110.328 179.481 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.3 mt -101.7 105.57 18.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.107 -179.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.649 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 20.4 m120 -96.57 123.87 40.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.836 177.243 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -104.76 147.54 27.59 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.848 0.356 . . . . 0.0 110.863 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.599 ' HE1' ' O ' ' A' ' 126' ' ' HIS . 78.3 m-85 -126.99 114.29 17.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.652 -177.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.8 t 56.46 -150.18 0.44 Allowed 'General case' 0 CA--C 1.534 0.358 0 O-C-N 123.585 0.553 . . . . 0.0 109.702 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.515 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 26.0 p -89.45 -55.91 3.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 173.194 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.4 m 67.22 -69.68 0.13 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 174.021 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -129.9 179.75 5.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.181 -168.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -71.99 -27.4 62.73 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -73.38 -6.38 45.86 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.144 172.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.515 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -79.82 0.06 83.46 Favored Glycine 0 C--O 1.23 -0.129 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.653 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -49.14 -21.11 0.68 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.276 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -59.29 -21.8 60.22 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.947 0.403 . . . . 0.0 111.07 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.2 t -82.11 129.53 34.84 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.407 ' HB3' ' HB2' ' A' ' 47' ' ' SER . 42.0 m-80 -78.41 5.16 11.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.865 0.364 . . . . 0.0 111.514 -178.166 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -92.88 -3.17 55.07 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 175.266 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.16 136.66 52.45 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.925 176.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.68 60.82 4.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.42 0.629 . . . . 0.0 111.067 -174.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -104.02 120.88 49.68 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.591 175.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.484 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 30.8 Cg_endo -64.34 124.24 13.06 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.89 2.393 . . . . 0.0 112.523 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.6 HG22 ' HA ' ' A' ' 104' ' ' LYS . 25.9 pt -113.27 156.34 14.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.516 177.675 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -111.1 97.11 6.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.99 0.424 . . . . 0.0 110.258 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.545 HG13 ' HD3' ' A' ' 99' ' ' LYS . 87.8 t -119.04 122.85 70.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.23 -174.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 58.71 30.23 19.68 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 123.844 0.715 . . . . 0.0 110.839 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.5 14.82 75.26 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.754 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -126.16 143.13 51.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.894 0.347 . . . . 0.0 110.454 -179.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.3 m -91.5 115.74 28.29 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.348 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.503 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 72.9 m95 -105.23 133.18 20.28 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.926 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 8.9 Cg_exo -71.67 -11.26 27.76 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 123.071 2.514 . . . . 0.0 113.012 -177.035 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -165.6 146.6 7.06 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.407 ' HB2' ' HB3' ' A' ' 31' ' ' ASN . 14.7 m -57.59 -39.12 76.08 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.319 0.387 . . . . 0.0 111.107 178.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.406 ' OE1' ' HB2' ' A' ' 75' ' ' ALA . 41.4 tt0 -61.19 -28.01 68.83 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.675 -178.006 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.512 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 14.8 m80 -64.37 -44.74 90.41 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.847 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -74.19 -36.76 64.03 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.176 0.512 . . . . 0.0 110.005 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -61.61 -46.76 88.44 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.567 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.547 ' HB3' HD13 ' A' ' 65' ' ' ILE . 0.6 OUTLIER -71.72 -31.17 66.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.482 -178.941 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.4 ' HB1' ' HG2' ' A' ' 62' ' ' ARG . . . -65.97 -45.98 79.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.791 0.329 . . . . 0.0 111.001 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -77.2 -15.15 59.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.881 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 52' ' ' GLN . 87.1 tttt -63.22 -34.36 77.49 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.506 177.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -108.24 155.84 20.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.298 -178.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.696 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.5 pt? -108.1 11.84 27.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.13 -177.12 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -95.91 120.38 36.09 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 177.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.443 ' CD ' ' H ' ' A' ' 59' ' ' GLU . 1.5 mp0 -57.72 -43.51 85.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.606 -173.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 64' ' ' GLU . 86.3 tttt -64.76 -56.88 10.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.728 -176.012 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.424 ' CZ ' ' HE2' ' A' ' 83' ' ' LYS . 7.1 t80 -60.61 -35.74 76.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.197 0.522 . . . . 0.0 110.14 -178.325 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.543 ' HE ' ' HG3' ' A' ' 63' ' ' GLU . 2.6 tmm_? -58.48 -46.25 87.04 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.493 176.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.546 ' HA ' ' HB3' ' A' ' 66' ' ' ARG . 35.4 mt-10 -83.51 -7.17 59.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.917 -177.129 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 19.0 mm-40 -74.67 -39.32 62.08 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 169.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.547 HD13 ' HB3' ' A' ' 52' ' ' GLN . 54.7 mt -70.6 -26.19 28.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.602 175.335 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.546 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . 25.7 tpt180 -72.53 -29.58 63.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.506 172.284 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 25.9 ttm-85 -80.65 -37.41 30.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.889 -175.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.515 HG21 ' HB ' ' A' ' 73' ' ' VAL . 11.1 p -71.41 120.39 19.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.443 0.64 . . . . 0.0 111.332 -176.721 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.0 t -80.42 -36.19 34.05 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.533 178.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.7 m -69.72 124.35 90.42 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.744 -178.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.512 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 35.4 Cg_endo -65.53 -45.45 6.89 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.866 2.377 . . . . 0.0 113.083 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 25.0 ttt -63.75 -26.05 68.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.586 -174.426 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.515 ' HB ' HG21 ' A' ' 68' ' ' VAL . 54.2 t -72.53 -36.67 54.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.96 0.41 . . . . 0.0 110.16 178.254 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.98 -44.35 89.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.88 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.588 ' O ' ' HG2' ' A' ' 79' ' ' ARG . . . -57.45 -48.92 77.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.679 173.327 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -51.89 -64.06 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.842 -178.178 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -80.75 -4.88 56.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.134 0.493 . . . . 0.0 111.001 -175.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.52 -25.29 39.65 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 121.033 -0.604 . . . . 0.0 111.923 175.143 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.588 ' HG2' ' O ' ' A' ' 75' ' ' ALA . 58.6 mmt-85 -89.72 3.84 51.48 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 177.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -59.47 -42.85 92.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.798 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 71.25 -15.92 0.39 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.534 0.734 . . . . 0.0 112.341 173.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.1 m -90.27 23.61 2.84 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.219 0.533 . . . . 0.0 110.563 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.424 ' HE2' ' CZ ' ' A' ' 61' ' ' TYR . 12.3 mmmt -109.44 162.47 20.07 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 177.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.42 114.47 2.14 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.173 1.915 . . . . 0.0 112.154 178.046 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 92.5 mt -84.89 154.26 22.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.045 -177.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -82.34 144.8 30.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.957 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -69.39 -51.97 31.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.118 0.485 . . . . 0.0 111.011 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -86.59 27.56 0.95 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.939 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.465 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 41.3 t-105 -62.15 -23.42 66.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.571 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.448 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 40.5 mm-40 -76.18 -18.63 59.0 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.016 178.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.1 m -99.8 -19.13 16.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.858 -177.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.44 ' HB ' HG23 ' A' ' 96' ' ' VAL . 28.3 m -111.06 2.11 8.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -168.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 59.4 mttp -60.05 -59.91 4.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.448 0.642 . . . . 0.0 110.424 -179.509 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.567 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 1.4 pm0 -78.87 -17.19 56.01 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.04 -177.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.435 ' HB3' ' HA ' ' A' ' 92' ' ' VAL . 64.2 tt0 -77.75 -48.28 17.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.484 179.428 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.44 HG23 ' HB ' ' A' ' 92' ' ' VAL . 68.3 t -64.77 -40.85 90.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 120.963 0.411 . . . . 0.0 109.909 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.8 tpp -60.16 -39.08 85.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.483 177.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -63.59 -40.94 98.23 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.439 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.545 ' HD3' HG13 ' A' ' 39' ' ' VAL . 39.0 ttmt -63.48 -46.51 85.83 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 177.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.61 -43.58 98.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.643 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.704 ' HB3' HD22 ' A' ' 152' ' ' LEU . 35.4 mt -60.13 -49.63 76.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.464 178.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.594 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 32.1 ttt180 -64.84 -45.78 84.68 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.533 -178.61 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.44 -28.7 68.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.191 0.519 . . . . 0.0 110.786 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.6 ' HA ' HG22 ' A' ' 37' ' ' ILE . 53.9 tttm -70.24 -53.7 15.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.791 179.428 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -86.82 -0.03 55.69 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -177.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.864 ' HA ' HH21 ' A' ' 112' ' ' ARG . 1.8 mm-40 -92.08 -40.64 10.94 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.628 0.251 . . . . 0.0 110.846 172.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -71.26 -38.89 71.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.947 0.403 . . . . 0.0 110.758 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -109.33 110.19 21.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.155 -175.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.5 -24.03 63.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.176 176.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.445 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.4 mp0 -58.71 -54.17 50.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.718 176.181 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 27.9 mt -69.59 -35.53 75.42 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.478 -176.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.864 HH21 ' HA ' ' A' ' 106' ' ' GLU . 42.5 ttm180 -57.37 -47.47 81.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.876 178.433 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.74 95.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.643 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.0 tp -61.29 -47.53 85.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.507 178.261 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.27 -45.67 92.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.026 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.526 HD21 ' HB2' ' A' ' 156' ' ' LEU . 74.3 mt -68.43 -18.82 64.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.6 -177.395 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -77.9 -7.28 56.51 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 63.5 p -85.3 -32.73 22.36 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.514 -178.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.04 136.36 14.38 Favored Pre-proline 0 N--CA 1.467 0.42 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -100.4 35.54 7.16 Favored 'Cis proline' 0 C--N 1.349 0.567 0 C-N-CA 124.45 -1.063 . . . . 0.0 113.156 -1.221 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -66.26 149.5 50.26 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.652 0.263 . . . . 0.0 111.222 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.562 ' HB2' HG12 ' A' ' 16' ' ' ILE . 55.7 mttp -79.87 125.38 29.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.735 179.368 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 53.9 mt -90.62 100.97 13.72 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.649 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 98.8 t -133.45 126.86 52.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.962 -174.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.575 ' CD ' HG22 ' A' ' 127' ' ' THR . 0.0 OUTLIER -83.6 136.59 34.18 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 174.425 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.762 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 72.5 t60 -134.26 77.24 1.69 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.955 0.407 . . . . 0.0 110.051 172.256 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.575 HG22 ' CD ' ' A' ' 125' ' ' GLU . 8.9 t -112.97 130.46 56.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.292 0.568 . . . . 0.0 109.544 175.377 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.506 ' HG2' ' CA ' ' A' ' 137' ' ' GLY . 29.2 mt-10 -87.81 12.35 13.2 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.436 -175.129 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -91.24 -35.24 14.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.583 -178.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -152.44 135.6 15.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.78 0.324 . . . . 0.0 110.864 -177.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.563 ' HB2' ' HA3' ' A' ' 136' ' ' GLY . . . -110.58 91.72 3.77 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.298 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -153.75 -31.15 0.12 Allowed 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.115 -178.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.418 ' HB3' HD22 ' A' ' 145' ' ' LEU . 78.6 m95 -137.15 36.92 2.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.591 0.234 . . . . 0.0 111.54 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.502 ' HA3' ' CD ' ' A' ' 125' ' ' GLU . . . -174.08 -114.9 0.37 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.162 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.762 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 16.3 t70 -111.62 -33.73 6.27 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.895 0.379 . . . . 0.0 110.866 -176.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' GLY . . . . . 0.563 ' HA3' ' HB2' ' A' ' 131' ' ' ALA . . . 74.2 6.5 74.85 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.031 177.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.506 ' CA ' ' HG2' ' A' ' 128' ' ' GLU . . . 78.7 40.69 17.26 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.917 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -178.02 -22.68 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' GLY . . . . . 0.422 ' HA2' ' OD2' ' A' ' 135' ' ' ASP . . . 127.28 -44.11 1.27 Allowed Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.222 -0.989 . . . . 0.0 113.043 174.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -91.37 68.39 5.83 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.778 0.799 . . . . 0.0 109.163 -177.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.456 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -123.1 14.89 8.31 Favored Glycine 0 C--N 1.311 -0.838 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.842 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 75.8 mttt 61.74 69.77 0.62 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.28 0.562 . . . . 0.0 111.732 173.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' ASN . . . . . 0.464 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 7.6 t30 -72.92 5.54 3.21 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.337 -174.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.593 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 77.8 mtm-85 -48.07 -24.21 1.03 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.418 HD22 ' HB3' ' A' ' 133' ' ' TRP . 50.7 tp -57.25 -56.05 26.77 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.656 0.265 . . . . 0.0 110.764 174.142 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.55 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -64.49 -30.43 77.85 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 121.282 -0.485 . . . . 0.0 111.895 178.008 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -64.58 -42.3 95.69 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 95.3 mt -61.5 -41.24 96.98 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.095 175.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.87 -38.77 89.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.025 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 63.9 mtt -60.46 -51.25 70.26 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.162 0.506 . . . . 0.0 110.217 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -64.6 -41.02 96.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.849 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.704 HD22 ' HB3' ' A' ' 101' ' ' LEU . 54.7 tp -62.34 -42.04 99.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 178.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -59.48 -56.27 24.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.539 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.6 -32.99 70.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.049 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -64.25 -40.03 95.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.789 177.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.526 ' HB2' HD21 ' A' ' 116' ' ' LEU . 96.0 mt -77.69 -22.98 49.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.985 0.421 . . . . 0.0 110.613 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.41 -50.37 26.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.045 174.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 80.7 mt -65.05 -26.25 39.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.402 178.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -52.76 -40.72 63.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.602 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -74.58 -30.62 61.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.827 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.7 mp -70.75 -33.54 70.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.215 0.531 . . . . 0.0 110.361 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 . . . . . 0 C--N 1.325 -0.496 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.176 174.143 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.234 0.27 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.839 ' HB2' ' HB3' ' A' ' 25' ' ' ASP . 21.6 ttt180 -128.04 50.5 2.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.107 0.48 . . . . 0.0 110.249 177.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.474 ' HA ' HD13 ' A' ' 114' ' ' LEU . . . -74.84 58.63 0.84 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.562 0.696 . . . . 0.0 110.063 174.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 . . . . . 0 C--N 1.324 -0.543 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.627 -177.668 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 35.7 t-80 . . . . . 0 N--CA 1.451 -0.379 0 CA-C-O 121.003 0.43 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.53 HG21 ' HD2' ' A' ' 120' ' ' PRO . 33.3 m -99.74 170.56 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.3 mtt -72.67 -74.53 0.16 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.618 0.723 . . . . 0.0 109.695 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -175.71 -56.45 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.955 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -125.59 72.59 1.28 Allowed 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.26 -1.337 . . . . 0.0 107.648 168.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.59 ' HB ' ' HB2' ' A' ' 121' ' ' ALA . 4.2 m -76.62 154.54 34.26 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.622 -170.635 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.9 mm -115.79 124.11 71.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.422 HG12 ' HB1' ' A' ' 121' ' ' ALA . 45.5 mm -106.9 101.72 12.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.029 178.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -100.48 104.43 15.82 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -118.01 137.98 52.51 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.45 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.579 ' CE1' ' HA ' ' A' ' 127' ' ' THR . 8.9 t80 -150.28 149.33 29.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.486 176.336 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.5 p 66.61 154.01 0.08 Allowed 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.669 1.188 . . . . 0.0 111.941 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.564 HG21 ' HA ' ' A' ' 33' ' ' ALA . 1.8 m -93.98 0.23 55.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.539 0.685 . . . . 0.0 109.841 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m -75.12 -32.15 61.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.397 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.83 161.03 24.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.468 177.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.839 ' HB3' ' HB2' ' A' ' 4' ' ' ARG . 2.8 m-20 -68.05 -24.68 65.1 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.637 -176.786 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -76.37 -1.36 26.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.788 175.261 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 30' ' ' SER . . . -65.98 -3.27 16.06 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.808 -0.633 . . . . 0.0 113.176 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -61.63 -30.29 70.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.122 0.461 . . . . 0.0 110.553 174.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -72.94 -23.82 60.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.852 177.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 27' ' ' GLY . 29.2 t -58.83 138.1 57.42 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.464 0.649 . . . . 0.0 111.48 -176.601 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -72.93 -17.09 61.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.705 177.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -90.51 -5.62 55.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.365 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.564 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -64.0 146.86 53.36 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.832 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.38 59.22 3.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.268 0.556 . . . . 0.0 111.719 -174.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -109.99 109.7 59.05 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.993 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.53 139.08 68.41 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.703 2.268 . . . . 0.0 112.178 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.497 HG22 ' HA ' ' A' ' 104' ' ' LYS . 27.2 pt -124.86 138.31 54.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.018 0.437 . . . . 0.0 111.275 -177.156 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.623 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 50.0 tptt -97.66 106.59 18.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.193 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.406 HG11 ' CZ ' ' A' ' 50' ' ' TYR . 15.9 t -126.44 126.84 69.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.45 -174.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 54.71 23.74 5.03 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 124.043 0.84 . . . . 0.0 112.141 173.392 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.04 -14.67 31.26 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.667 -0.777 . . . . 0.0 113.416 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -121.52 153.73 37.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.913 0.857 . . . . 0.0 111.322 -175.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 12.1 m -99.41 108.66 21.2 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.214 -176.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.472 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 48.3 m95 -97.99 135.18 21.54 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.607 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.585 ' O ' HG22 ' A' ' 46' ' ' THR . 11.4 Cg_exo -71.78 57.46 2.51 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.788 2.326 . . . . 0.0 112.412 176.768 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 45' ' ' PRO . 0.7 OUTLIER 92.98 170.11 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.672 1.589 . . . . 0.0 112.708 172.436 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 m -49.33 -47.82 46.93 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 114.33 -1.304 . . . . 0.0 112.517 -172.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -54.38 -33.53 59.38 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.917 0.389 . . . . 0.0 111.604 -175.662 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.413 ' CE1' ' HB2' ' A' ' 45' ' ' PRO . 44.7 m80 -75.66 -43.57 46.91 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 122.057 -0.402 . . . . 0.0 110.822 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.452 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 42.9 t80 -70.29 -26.28 63.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.952 0.406 . . . . 0.0 110.396 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.489 ' HA ' HG11 ' A' ' 96' ' ' VAL . 27.3 t80 -62.81 -52.87 61.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.512 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.78 ' HB3' HD13 ' A' ' 65' ' ' ILE . 2.4 mp0 -62.97 -34.39 77.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.594 174.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.684 ' HA ' ' HG2' ' A' ' 62' ' ' ARG . . . -65.72 -29.02 69.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.707 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -105.41 2.92 29.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.124 0.487 . . . . 0.0 110.06 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -83.71 -57.94 3.01 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.214 174.18 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.579 ' CE1' ' HB2' ' A' ' 83' ' ' LYS . 57.0 m-85 -88.02 143.24 27.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.505 -179.025 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.759 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.5 pt? -102.08 8.71 40.74 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.631 0.253 . . . . 0.0 111.657 -175.095 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -89.43 121.74 31.96 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.27 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -59.03 -44.86 91.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.443 -176.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -68.47 -52.73 29.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.508 -174.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -67.28 -30.74 70.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.857 0.36 . . . . 0.0 110.864 -178.337 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.684 ' HG2' ' HA ' ' A' ' 53' ' ' ALA . 5.3 tmm_? -68.67 -34.46 75.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.298 0.57 . . . . 0.0 109.5 177.685 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -67.18 -27.76 67.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.534 175.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.429 ' O ' ' HB3' ' A' ' 67' ' ' ARG . 1.3 tp10 -72.74 -28.61 62.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.231 176.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.78 HD13 ' HB3' ' A' ' 52' ' ' GLN . 37.9 mt -77.05 -22.24 14.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.276 0.56 . . . . 0.0 110.595 177.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -76.69 -19.74 57.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 170.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' A' ' 64' ' ' GLU . 7.3 tpp180 -75.78 -43.53 46.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.605 -179.291 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.7 p -63.86 120.34 10.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.334 0.588 . . . . 0.0 110.423 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.2 m -86.0 -31.72 21.89 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.289 -177.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.425 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 35.5 t -72.32 123.37 89.41 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.77 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 17.0 Cg_exo -67.8 -34.41 24.35 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.74 2.293 . . . . 0.0 111.652 177.054 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.473 ' HA ' ' CE ' ' A' ' 72' ' ' MET . 2.2 tpt -67.48 -47.25 70.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.521 -178.506 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.8 t -65.3 -37.48 80.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.46 -47.55 83.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.83 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.534 ' O ' ' HG3' ' A' ' 79' ' ' ARG . . . -66.7 -41.13 88.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.443 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.3 tpt180 -55.3 -53.73 52.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.032 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -80.2 -23.78 40.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.815 0.34 . . . . 0.0 110.775 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.56 -8.24 85.91 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.955 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 75' ' ' ALA . 89.7 mtt180 -89.34 -6.83 56.34 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 122.392 -0.475 . . . . 0.0 110.921 175.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -71.87 125.26 26.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.011 0.434 . . . . 0.0 109.955 176.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.659 ' HG3' HD11 ' A' ' 85' ' ' LEU . 14.5 ttm180 -96.9 15.58 21.82 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.554 -174.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.1 m -91.74 -8.04 48.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.931 178.09 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.579 ' HB2' ' CE1' ' A' ' 56' ' ' PHE . 45.2 mmtm -88.77 162.32 38.99 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.422 176.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 51.5 Cg_endo -68.7 100.92 0.72 Allowed 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 121.883 1.722 . . . . 0.0 112.532 -178.27 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.659 HD11 ' HG3' ' A' ' 81' ' ' ARG . 97.1 mt -84.35 150.13 25.58 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.686 174.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -82.28 143.35 31.38 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 174.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -57.99 -31.43 66.92 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -169.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -104.6 21.99 15.81 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 121.031 -0.268 . . . . 0.0 111.296 -176.186 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.451 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 43.3 t-105 -58.43 -48.53 80.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.451 -177.117 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.967 ' HA ' ' HE3' ' A' ' 93' ' ' LYS . 1.0 OUTLIER -55.99 -23.38 32.3 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -177.164 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.0 p -99.91 -17.37 17.62 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.9 m -105.53 7.05 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.967 ' HE3' ' HA ' ' A' ' 90' ' ' GLU . 97.6 mttt -59.5 -41.9 90.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.086 0.47 . . . . 0.0 111.061 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.494 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 5.0 pt-20 -73.0 -24.33 60.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.161 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -72.3 -43.36 64.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.162 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.489 HG11 ' HA ' ' A' ' 51' ' ' PHE . 62.7 t -62.12 -38.64 81.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.197 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 21.8 mmt -59.62 -38.84 82.41 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.814 176.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.494 ' HG3' ' O ' ' A' ' 94' ' ' GLU . 81.7 mtt180 -59.05 -44.97 91.87 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.996 0.427 . . . . 0.0 110.773 177.017 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 tmtp? -66.72 -49.52 65.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.575 -178.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.26 68.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.72 -176.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.493 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 41.7 mt -64.58 -36.14 83.26 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -177.302 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.571 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 70.8 ttt180 -65.09 -53.62 42.7 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.784 177.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.44 -32.93 67.4 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.99 0.424 . . . . 0.0 110.82 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.497 ' HA ' HG22 ' A' ' 37' ' ' ILE . 58.7 tttp -54.51 -52.78 60.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.958 175.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -82.42 -30.92 29.85 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.605 ' HA ' ' NH2' ' A' ' 112' ' ' ARG . 28.6 mm-40 -63.46 -49.15 74.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.59 0.233 . . . . 0.0 111.604 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.623 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 79.6 mm-40 -74.47 -20.88 59.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -175.411 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -116.1 105.02 12.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.808 0.337 . . . . 0.0 111.17 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.54 -27.75 69.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.194 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.445 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.5 mp0 -57.17 -51.27 70.0 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.69 175.629 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 67.2 mt -73.05 -39.18 66.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.958 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.605 ' NH2' ' HA ' ' A' ' 106' ' ' GLU . 35.1 ttm-85 -57.9 -44.73 86.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.856 0.36 . . . . 0.0 110.569 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.27 -41.26 94.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.806 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 5' ' ' ALA . 57.8 tp -62.53 -41.83 99.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.54 178.044 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 62.0 tp -65.16 -40.25 94.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.892 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.478 HD21 ' HB2' ' A' ' 156' ' ' LEU . 43.3 mt -81.05 -6.41 58.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.772 0.32 . . . . 0.0 111.042 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.31 -31.99 22.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.069 177.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.9 p -72.9 -21.82 60.84 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.211 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.531 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -52.48 139.0 39.29 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.439 178.815 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.53 ' HD2' HG21 ' A' ' 11' ' ' VAL . 41.2 Cg_endo -100.1 40.66 4.16 Favored 'Cis proline' 0 CA--C 1.534 0.519 0 C-N-CA 124.371 -1.095 . . . . 0.0 113.241 -0.205 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.59 ' HB2' ' HB ' ' A' ' 15' ' ' THR . . . -66.77 154.69 40.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.302 0.572 . . . . 0.0 112.108 -177.353 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.31 119.21 23.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.61 179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 23.3 mt -86.31 112.78 21.73 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.804 0.335 . . . . 0.0 110.67 -176.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.8 t -129.13 127.24 65.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.073 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -97.55 129.19 44.71 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.213 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -91.22 77.36 5.95 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.579 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -77.57 86.22 3.9 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.966 -177.777 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -76.62 -18.25 58.71 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.769 -175.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -90.53 -29.88 17.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.622 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ASP . . . . . 0.441 ' O ' ' HB ' ' A' ' 127' ' ' THR . 8.9 t70 -145.51 138.87 26.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.816 -172.685 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.532 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -99.86 86.01 3.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 176.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -151.7 -34.87 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.954 -177.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.652 ' HB3' HD22 ' A' ' 145' ' ' LEU . 71.1 m95 -119.12 -0.23 11.12 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -172.271 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -155.39 -120.83 0.72 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 119.631 -1.271 . . . . 0.0 113.19 -172.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.516 ' HB2' ' HA2' ' A' ' 139' ' ' GLY . 1.2 p-10 -105.54 -10.21 17.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.957 0.408 . . . . 0.0 110.83 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 72.2 12.32 76.03 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.52 174.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 80.2 19.57 69.17 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.879 -178.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -163.42 19.21 0.07 Allowed 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' GLY . . . . . 0.516 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 79.86 -0.44 82.49 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 120.579 -0.82 . . . . 0.0 114.306 174.374 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -138.2 72.02 1.4 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.445 0.623 . . . . 0.0 110.121 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.532 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -129.07 15.15 5.88 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.558 -172.647 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.401 ' C ' ' H ' ' A' ' 144' ' ' ARG . 33.0 tttm 68.17 80.35 0.2 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.0 0.905 . . . . 0.0 110.523 179.197 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.38 5.33 1.81 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 114.363 -1.29 . . . . 0.0 110.906 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.659 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 24.5 ttt180 -48.09 -26.83 2.0 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.201 0.6 . . . . 0.0 112.576 -176.074 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 133' ' ' TRP . 37.6 tp -64.22 -48.57 75.35 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.058 0.456 . . . . 0.0 110.108 178.164 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -64.76 -29.05 74.21 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.549 177.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -70.2 -38.8 75.4 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 176.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.659 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 89.5 mt -58.26 -49.82 75.77 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.249 0.547 . . . . 0.0 109.531 174.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.49 HD21 HD13 ' A' ' 101' ' ' LEU . 96.4 mt -65.21 -31.3 72.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.881 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.6 tpp -61.92 -53.04 61.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.085 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -69.26 -33.97 74.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.538 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.428 ' O ' ' HG2' ' A' ' 155' ' ' GLN . 61.7 tp -60.74 -46.14 91.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.058 0.456 . . . . 0.0 110.071 175.332 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.531 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 54.0 ttp85 -58.83 -49.54 77.32 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.029 177.495 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 154' ' ' GLU . . . . . 0.466 ' O ' HG13 ' A' ' 158' ' ' ILE . 44.4 mt-10 -71.66 -32.04 67.47 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -176.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 152' ' ' LEU . 9.3 pt20 -71.66 -32.19 67.64 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.427 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.478 ' HB2' HD21 ' A' ' 116' ' ' LEU . 84.5 mt -73.78 -25.81 60.32 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.462 ' O ' ' HB3' ' A' ' 160' ' ' LYS . . . -72.18 -43.64 64.24 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.055 173.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.508 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 87.2 mt -62.91 -42.91 98.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 175.426 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -58.14 -31.35 67.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.107 175.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 160' ' ' LYS . . . . . 0.987 ' HA ' ' HE3' ' A' ' 160' ' ' LYS . 0.4 OUTLIER -66.86 -40.28 87.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.929 177.26 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.32 -23.31 65.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.666 177.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 158' ' ' ILE . 22.7 mm-40 . . . . . 0 C--N 1.323 -0.577 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.167 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.5 t . . . . . 0 N--CA 1.452 -0.336 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 4' ' ' ARG . 24.8 ttp85 60.23 54.02 4.19 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.19 178.442 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.1 77.66 4.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.228 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.953 -179.852 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 . . . . . 0 N--CA 1.454 -0.244 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.405 HG21 ' HD2' ' A' ' 120' ' ' PRO . 35.0 m -59.46 146.7 9.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.277 0.56 . . . . 0.0 111.308 -179.092 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.4 mtm -94.14 22.66 5.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.391 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 68.42 -70.05 0.14 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.549 -173.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -77.9 44.79 0.48 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.88 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.9 m -97.75 113.32 25.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.625 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.7 mt -111.41 105.75 19.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 176.326 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 71.3 mt -92.67 102.02 13.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.728 -173.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.601 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 6.2 p30 -103.19 133.94 47.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.674 177.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -140.39 141.54 35.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.035 -175.049 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.668 ' O ' ' HB2' ' A' ' 21' ' ' SER . 6.6 t80 -150.27 100.22 2.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.182 165.083 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.668 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 6.0 t 150.19 110.7 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 124.85 1.344 . . . . 0.0 108.013 179.186 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.693 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 2.9 m -74.43 -70.26 0.41 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.1 m 47.46 -92.57 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.805 0.842 . . . . 0.0 113.087 174.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -157.24 27.27 0.3 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.524 0.678 . . . . 0.0 109.246 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.409 ' HA ' ' NH2' ' A' ' 4' ' ' ARG . 3.6 t70 -117.94 -153.16 0.52 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.166 -173.281 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -66.84 -1.31 3.78 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.018 0.437 . . . . 0.0 111.165 177.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.693 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -65.48 -0.45 6.29 Favored Glycine 0 C--O 1.225 -0.44 0 CA-C-N 115.749 -0.66 . . . . 0.0 113.504 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -56.48 -26.87 55.53 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 117.296 0.548 . . . . 0.0 111.315 175.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -66.55 -24.91 66.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.625 177.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.4 m -69.41 128.97 38.44 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 174.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 -76.09 10.52 1.89 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -172.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -95.01 2.2 55.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.223 0.535 . . . . 0.0 109.65 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.24 129.76 41.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.872 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.439 ' HA ' HG23 ' A' ' 46' ' ' THR . . . -86.8 62.89 7.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.414 0.626 . . . . 0.0 111.037 -174.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -102.15 125.51 36.36 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.563 175.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -61.61 116.78 3.65 Favored 'Trans proline' 0 C--O 1.239 0.563 0 C-N-CA 122.377 2.051 . . . . 0.0 111.119 174.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.586 HG22 ' HA ' ' A' ' 104' ' ' LYS . 26.1 pt -116.94 132.77 65.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.963 -178.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.962 ' HB3' HE21 ' A' ' 107' ' ' GLN . 5.0 tppp? -91.76 103.85 16.36 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 177.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.7 t -121.31 115.21 45.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.676 -177.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 64.64 14.82 9.3 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.568 176.087 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 114.57 -12.56 20.96 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.114 177.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -110.43 143.86 40.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 117.282 0.541 . . . . 0.0 111.564 -177.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.7 m -92.72 103.62 15.97 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.189 178.312 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.512 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 66.4 m95 -91.18 134.29 30.18 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.512 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 5.1 Cg_exo -76.44 -1.36 11.42 Favored 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 123.05 2.5 . . . . 0.0 112.743 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.439 HG23 ' HA ' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -169.73 150.31 3.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.202 -178.704 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.9 m -58.1 -40.68 81.78 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.318 0.386 . . . . 0.0 110.426 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.464 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 14.4 tp10 -57.68 -31.32 66.23 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.511 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.453 ' HE2' HG13 ' A' ' 68' ' ' VAL . 10.2 m80 -64.96 -43.9 91.15 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 122.074 -0.391 . . . . 0.0 111.138 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -72.3 -35.28 68.62 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 177.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.571 ' CD2' ' HE3' ' A' ' 55' ' ' LYS . 1.7 t80 -60.3 -46.5 89.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.557 177.122 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.601 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 79.2 mm-40 -57.88 -46.19 85.25 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.444 175.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.95 -33.4 68.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.521 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.42 ' HB3' ' HZ3' ' A' ' 89' ' ' TRP . 1.6 tp-100 -92.13 -14.58 28.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.741 -178.565 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.571 ' HE3' ' CD2' ' A' ' 51' ' ' PHE . 91.8 mttt -67.73 -38.52 83.65 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.044 0.45 . . . . 0.0 111.141 178.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -110.45 139.41 45.7 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.844 -174.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.847 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.8 pt? -89.53 -7.87 53.99 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.626 -175.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -73.03 138.83 46.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.949 0.404 . . . . 0.0 110.714 -177.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -72.0 -39.48 69.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.781 -175.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -82.86 -36.03 25.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.793 0.33 . . . . 0.0 110.54 -174.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.526 ' O ' HG12 ' A' ' 65' ' ' ILE . 4.9 t80 -66.52 -37.66 85.51 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.138 178.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 38.4 ttp-105 -66.78 -37.62 84.93 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.662 0.744 . . . . 0.0 109.696 174.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 34.0 tt0 -63.27 -33.19 74.97 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.294 175.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.421 ' OE2' ' HD2' ' A' ' 67' ' ' ARG . 5.7 tp10 -69.25 -36.1 76.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.965 177.316 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.526 HG12 ' O ' ' A' ' 61' ' ' TYR . 50.3 mm -60.66 -34.11 57.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.391 176.789 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -65.36 -32.92 74.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.973 175.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 45.9 mtt180 -81.7 -33.2 31.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.789 -172.398 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.453 HG13 ' HE2' ' A' ' 49' ' ' HIS . 7.2 p -68.8 112.57 3.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.351 0.596 . . . . 0.0 111.482 -176.297 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.6 m -71.98 -40.38 68.63 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.01 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 19.4 m -81.45 132.95 54.07 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.719 -173.13 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 20.9 Cg_exo -67.03 -44.18 5.52 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 123.179 2.586 . . . . 0.0 112.943 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.3 tpt -67.63 -36.8 81.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.753 0.311 . . . . 0.0 110.947 -173.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 67.2 t -62.71 -43.15 98.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.304 178.251 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.28 -43.43 91.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.399 177.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.64 -39.9 95.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.891 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.466 ' HD3' ' C ' ' A' ' 76' ' ' ARG . 1.9 tmt_? -61.52 -53.88 50.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.711 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -74.48 -15.61 60.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.777 0.322 . . . . 0.0 111.178 -176.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.601 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -93.94 -5.32 62.69 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.341 175.176 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 44.2 ttt180 -98.79 -5.84 30.44 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -81.54 118.92 23.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.686 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 34.0 ttm105 -92.95 66.73 4.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.503 0.668 . . . . 0.0 110.604 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 95.0 p -138.69 8.0 2.56 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.707 0.765 . . . . 0.0 109.06 167.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -99.99 160.05 28.22 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.535 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.46 101.61 0.54 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.151 1.9 . . . . 0.0 111.509 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 69.0 mt -77.5 136.82 38.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.899 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.54 ' HB3' ' HB2' ' A' ' 89' ' ' TRP . 16.8 ttt180 -66.98 131.81 46.64 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.136 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.425 ' HA ' ' HD2' ' A' ' 87' ' ' LYS . 20.1 tptp -62.9 -52.15 64.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.813 -172.052 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -89.64 20.34 4.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.501 0.191 . . . . 0.0 111.279 -177.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.54 ' HB2' ' HB3' ' A' ' 86' ' ' ARG . 63.7 t-105 -59.8 -33.35 71.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.947 0.403 . . . . 0.0 110.167 177.52 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.18 -40.65 77.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.333 179.215 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.5 p -85.82 -9.77 56.51 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -174.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.42 HG22 ' HA ' ' A' ' 89' ' ' TRP . 34.5 m -119.24 -4.43 10.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -176.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -53.21 -44.35 67.95 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.042 0.448 . . . . 0.0 111.676 -176.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 94' ' ' GLU . 5.6 pt-20 -83.28 -20.36 34.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.294 -175.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -75.43 -43.55 49.2 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 61.0 t -64.07 -41.89 93.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.99 177.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 52.6 tpp -58.51 -47.28 84.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.709 175.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -61.48 -42.78 99.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.954 -178.393 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.7 tttp -65.89 -45.36 82.3 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.817 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.55 -41.99 92.37 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.951 0.405 . . . . 0.0 110.73 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.474 ' HB3' HD22 ' A' ' 152' ' ' LEU . 17.5 mt -58.62 -48.65 80.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.309 177.4 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.9 ttt85 -58.97 -40.92 86.22 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.711 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.23 -37.15 82.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.126 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.586 ' HA ' HG22 ' A' ' 37' ' ' ILE . 27.1 ttpp -65.69 -42.69 90.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.64 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.603 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 82.3 m-85 -82.5 -24.12 34.32 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.244 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -77.74 -41.25 38.33 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 121.867 -0.521 . . . . 0.0 111.112 176.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.962 HE21 ' HB3' ' A' ' 38' ' ' LYS . 0.6 OUTLIER -83.31 -11.06 58.11 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.513 -176.276 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -129.24 105.25 8.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.048 0.451 . . . . 0.0 109.937 173.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.49 -30.32 70.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.025 -174.238 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -69.49 -34.2 73.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.814 0.34 . . . . 0.0 110.397 -179.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 36.2 mt -73.0 -38.19 66.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.611 177.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.603 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 22.7 ttm180 -59.8 -46.36 89.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.178 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.09 97.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.843 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.6 tp -58.13 -50.92 71.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.465 176.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 51.3 tp -58.74 -51.29 70.59 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.546 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.497 HD21 ' HB2' ' A' ' 156' ' ' LEU . 31.3 mt -68.5 -22.33 64.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.604 -174.05 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -78.26 -11.91 59.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.842 -178.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 68.8 p -80.52 -29.07 37.24 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.944 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -50.84 135.18 27.66 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.951 -178.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 68.9 Cg_endo -100.45 27.18 15.21 Favored 'Cis proline' 0 N--CA 1.458 -0.562 0 C-N-CA 124.338 -1.109 . . . . 0.0 113.2 0.131 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -58.57 150.94 21.67 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 120.92 0.39 . . . . 0.0 111.725 -177.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -87.29 117.71 26.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.49 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 31.6 mt -88.04 127.4 35.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.07 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.601 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 1.8 p -142.85 119.18 5.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.211 0.529 . . . . 0.0 111.007 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -91.57 131.52 36.93 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -91.99 77.13 5.43 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 119.544 -0.862 . . . . 0.0 108.767 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.73 86.13 5.35 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.544 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -85.96 -15.62 40.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.073 -176.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -82.98 -25.43 32.27 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.204 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -152.05 129.65 11.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.594 -176.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.51 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -100.03 85.71 3.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.867 -178.258 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -158.96 -26.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -177.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.523 ' HB3' HD22 ' A' ' 145' ' ' LEU . 49.1 m95 -131.52 22.01 4.72 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -168.01 -134.27 1.69 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 119.319 -1.42 . . . . 0.0 113.695 -177.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -76.09 -34.45 59.52 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.076 0.465 . . . . 0.0 111.095 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' GLY . . . . . 0.52 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 79.67 -2.4 73.5 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.651 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 84.93 9.91 79.8 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 121.277 -0.487 . . . . 0.0 112.499 179.087 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -168.19 23.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.525 0.203 . . . . 0.0 111.103 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 88.14 -51.45 4.0 Favored Glycine 0 CA--C 1.522 0.473 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.591 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -84.53 62.64 7.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.697 0.761 . . . . 0.0 110.655 -177.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.52 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -123.41 15.25 8.13 Favored Glycine 0 C--N 1.315 -0.627 0 CA-C-N 115.221 -0.899 . . . . 0.0 112.548 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' A' ' 142' ' ' LYS . 11.1 mptt 63.02 71.33 0.52 Allowed 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 122.962 0.505 . . . . 0.0 111.506 172.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' ASN . . . . . 0.561 ' OD1' HG23 ' A' ' 124' ' ' VAL . 6.3 t30 -71.92 5.71 2.47 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.284 -178.205 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.469 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 2.6 mpt_? -49.89 -22.05 1.37 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -179.018 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.523 HD22 ' HB3' ' A' ' 133' ' ' TRP . 62.8 tp -59.23 -45.5 90.98 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.613 0.244 . . . . 0.0 110.598 175.354 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.604 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -63.52 -30.83 78.77 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.751 176.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -71.77 -36.97 70.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 98.2 mt -62.14 -36.79 82.86 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 174.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.34 -38.81 92.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.337 174.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.604 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 58.1 mtt -64.04 -46.53 84.01 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 177.373 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -56.54 -51.08 69.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.583 177.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.474 HD22 ' HB3' ' A' ' 101' ' ' LEU . 56.4 tp -63.55 -48.42 77.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.879 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -56.77 -41.07 76.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.872 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' GLU . . . . . 0.445 ' O ' HG13 ' A' ' 158' ' ' ILE . 1.4 tp10 -61.39 -52.54 64.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.151 -178.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -65.34 -35.48 81.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.53 -175.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.497 ' HB2' HD21 ' A' ' 116' ' ' LEU . 87.4 mt -72.47 -35.01 68.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.856 0.36 . . . . 0.0 110.317 179.398 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.411 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -68.43 -47.85 66.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.506 177.609 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 154' ' ' GLU . 73.4 mt -62.24 -37.95 79.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.422 179.009 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -63.3 -31.8 73.05 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.34 0.59 . . . . 0.0 110.09 177.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -82.77 -12.27 57.64 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.716 179.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 161' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 157' ' ' ALA . 7.8 mp -96.51 -35.55 11.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.839 177.1 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.874 -177.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.457 ' HA ' ' CG ' ' A' ' 25' ' ' ASP . 56.8 t . . . . . 0 C--O 1.235 0.331 0 CA-C-O 121.051 0.453 . . . . 0.0 111.955 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.42 HH21 ' CG ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -83.65 86.45 7.12 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 173.908 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.64 76.55 10.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.066 -175.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 . . . . . 0 C--N 1.323 -0.565 0 CA-C-O 121.267 0.556 . . . . 0.0 109.706 176.746 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-O 120.875 0.369 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 5.5 m -83.47 149.62 4.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 171.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.429 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 0.6 OUTLIER -66.21 -80.21 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.072 -176.645 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.429 ' H ' ' HB2' ' A' ' 12' ' ' MET . 49.2 tt0 -169.32 83.38 0.13 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 173.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.3 t70 62.9 99.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.968 0.793 . . . . 0.0 110.114 -173.129 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.9 t -120.56 148.08 44.33 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.63 HG13 ' HD2' ' A' ' 122' ' ' LYS . 3.9 mp -86.34 104.74 14.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.968 0.413 . . . . 0.0 110.049 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.6 mt -90.03 89.93 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-O 121.281 0.562 . . . . 0.0 109.881 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.4 p30 -84.16 102.06 12.3 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 171.079 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -100.7 137.27 39.32 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.625 -171.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -150.72 -179.34 7.18 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.578 175.435 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 48.2 m 66.48 93.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.671 0.748 . . . . 0.0 110.666 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.439 HG21 ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -81.39 3.41 24.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.962 -176.025 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 m -46.12 -47.47 17.39 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.348 -0.842 . . . . 0.0 113.255 -175.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.42 ' CG ' HH21 ' A' ' 4' ' ' ARG . 2.6 p-10 -115.11 -175.47 2.7 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.921 -0.487 . . . . 0.0 110.996 -179.478 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.457 ' CG ' ' HA ' ' A' ' 3' ' ' VAL . 5.0 m-20 -66.35 -26.39 67.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.915 -172.244 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -70.05 -15.57 63.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.292 0.568 . . . . 0.0 110.277 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -87.17 -0.27 85.3 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.222 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.87 -25.78 63.64 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -56.95 -25.83 58.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.7 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.3 m -70.3 141.85 52.3 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.949 0.404 . . . . 0.0 110.486 177.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -59.06 -33.34 70.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.221 0.534 . . . . 0.0 110.971 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -85.96 20.86 2.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.31 -173.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.439 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -70.21 138.65 51.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.787 0.327 . . . . 0.0 111.144 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.541 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -94.53 64.86 3.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.384 -175.068 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -117.17 122.87 30.65 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.992 174.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.14 127.66 24.91 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 122.864 2.376 . . . . 0.0 112.532 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.543 ' CG2' ' HA ' ' A' ' 104' ' ' LYS . 11.6 pt -123.9 141.61 43.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.053 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -102.57 87.83 3.09 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.472 HG22 ' HB3' ' A' ' 103' ' ' ALA . 16.0 t -108.41 130.07 61.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.838 -173.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 t70 64.87 26.39 12.87 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.777 0.673 . . . . 0.0 110.159 175.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 77.69 14.36 82.49 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.147 -178.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.9 mttp -125.46 148.71 48.73 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -176.319 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 35.9 m -93.16 126.46 38.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.702 0.287 . . . . 0.0 111.193 -178.1 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.446 ' HB2' HG13 ' A' ' 37' ' ' ILE . 35.4 m95 -125.59 133.55 24.99 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.322 178.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 11.9 Cg_exo -71.08 -29.95 16.98 Favored 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 122.763 2.309 . . . . 0.0 112.433 178.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.541 HG22 ' HA ' ' A' ' 34' ' ' ALA . 4.8 p -145.92 169.63 18.22 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.326 -177.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 m -69.42 -44.99 70.24 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.4 0.437 . . . . 0.0 111.971 -173.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.412 ' CD ' ' HG1' ' A' ' 46' ' ' THR . 0.4 OUTLIER -67.35 -15.17 63.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -173.814 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.413 ' O ' HG21 ' A' ' 65' ' ' ILE . 10.5 m80 -63.55 -52.18 62.21 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 174.485 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -65.96 -37.01 84.9 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.148 0.499 . . . . 0.0 109.931 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.53 -50.11 70.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.424 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -69.84 -37.03 76.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.382 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.597 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -62.83 -54.49 38.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.058 -175.282 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -73.63 -26.88 60.98 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.804 0.335 . . . . 0.0 110.417 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -56.07 -45.41 79.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.358 172.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -76.09 124.25 27.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.98 176.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.841 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.0 OUTLIER -81.05 -15.64 55.52 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.775 179.552 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -78.01 126.23 30.52 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 62' ' ' ARG . 10.7 tp10 -67.22 -38.17 84.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.504 -173.178 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.412 ' O ' ' HB3' ' A' ' 63' ' ' GLU . 41.7 mttm -83.41 -25.4 31.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -175.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.534 ' OH ' ' HE3' ' A' ' 83' ' ' LYS . 0.3 OUTLIER -80.82 -23.28 39.32 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.355 -0.938 . . . . 0.0 109.918 173.785 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.597 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 24.9 ttp180 -68.98 -35.58 76.89 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 167.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.412 ' HB3' ' O ' ' A' ' 60' ' ' LYS . 42.1 tt0 -64.83 -36.24 83.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.037 174.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.433 ' CD ' HH21 ' A' ' 67' ' ' ARG . 5.9 tp10 -58.93 -42.89 90.83 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.434 173.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.413 HG21 ' O ' ' A' ' 49' ' ' HIS . 45.6 mm -60.35 -37.13 73.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.979 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -72.15 -32.11 66.59 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.028 0.442 . . . . 0.0 110.415 175.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.433 HH21 ' CD ' ' A' ' 64' ' ' GLU . 35.1 ttp180 -70.57 -26.5 63.56 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.177 -175.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.2 m -87.49 121.97 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 121.485 0.66 . . . . 0.0 110.987 178.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.0 p -83.33 -13.42 55.12 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 173.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.9 m -85.89 117.48 68.8 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.455 -176.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.64 -46.62 0.82 Allowed 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 123.056 2.504 . . . . 0.0 111.954 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.9 tpt -62.51 -33.07 74.15 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.295 -176.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 93.9 t -69.29 -43.36 81.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.199 178.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.71 -38.74 92.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.619 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.99 -45.97 86.64 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.864 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 76' ' ' ARG . 42.4 mtm180 -62.59 -48.22 80.37 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.634 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.777 ' HA ' ' HB2' ' A' ' 80' ' ' ASP . 26.6 ptt? -75.47 -11.06 59.96 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.458 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.32 -32.01 65.56 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.284 -0.726 . . . . 0.0 111.284 169.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -96.64 11.13 36.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.613 0.244 . . . . 0.0 110.918 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.777 ' HB2' ' HA ' ' A' ' 77' ' ' MET . 28.1 t70 -67.2 -19.54 65.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.738 -175.075 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 74.29 -41.29 0.47 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.653 0.781 . . . . 0.0 111.966 177.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.8 m -83.06 33.15 0.44 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.183 0.516 . . . . 0.0 111.176 -178.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.534 ' HE3' ' OH ' ' A' ' 61' ' ' TYR . 47.4 mmtm -123.32 158.78 57.38 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.698 -178.327 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.18 103.04 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.603 2.202 . . . . 0.0 112.754 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 83' ' ' LYS . 73.7 mt -105.55 154.49 20.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.978 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.563 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 52.7 mtt180 -99.03 136.27 39.24 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.88 0.371 . . . . 0.0 110.866 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -60.95 -33.7 73.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.855 175.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -95.91 11.45 33.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.99 -176.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 61.8 t-105 -63.92 -33.58 76.04 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.479 -174.129 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.82 -23.52 66.7 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.921 0.391 . . . . 0.0 110.681 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.7 m -91.87 -46.05 8.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.235 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.78 2.36 5.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.662 0.268 . . . . 0.0 111.705 -175.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 89' ' ' TRP . 35.1 ttmt -55.75 -53.64 54.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.597 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -62.46 -35.0 77.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.089 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -66.63 -51.59 54.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.696 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.2 t -64.31 -40.57 89.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.29 178.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.481 ' HA ' ' CE ' ' A' ' 97' ' ' MET . 2.1 tpt -59.29 -48.85 80.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.677 178.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 44.5 ttp180 -62.48 -35.85 80.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.321 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -64.04 -45.57 88.26 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.153 0.501 . . . . 0.0 110.248 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.52 -42.98 95.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.549 177.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 97' ' ' MET . 92.8 mt -62.05 -36.16 80.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.156 178.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.518 ' HG3' HD11 ' A' ' 152' ' ' LEU . 59.2 ttp85 -62.63 -49.17 76.23 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.186 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.508 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -66.83 -29.75 69.76 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.185 0.517 . . . . 0.0 110.236 -178.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.543 ' HA ' ' CG2' ' A' ' 37' ' ' ILE . 57.5 tttp -59.91 -59.18 5.83 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.296 177.469 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.51 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 90.2 m-85 -80.07 -40.54 27.43 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.231 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.542 ' HA ' ' HD3' ' A' ' 112' ' ' ARG . 2.4 tm-20 -69.73 -37.99 76.69 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 121.154 -0.219 . . . . 0.0 111.385 -173.064 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 28.3 tp60 -65.05 -35.74 82.14 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.045 0.45 . . . . 0.0 110.552 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -108.83 101.45 10.56 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.91 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -53.25 -34.42 57.08 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 112.077 -175.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.78 -44.91 86.56 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.068 177.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 68.1 mt -73.73 -38.87 64.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.525 -177.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.702 ' HG3' HD13 ' A' ' 156' ' ' LEU . 41.9 ttp180 -62.15 -47.98 82.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.531 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.81 -34.67 77.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.023 0.44 . . . . 0.0 110.391 178.139 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 50.5 tp -63.29 -41.62 98.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.15 177.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 32.2 tp -63.49 -49.25 74.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.304 178.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.98 -19.16 65.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.556 -178.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.29 11.21 12.68 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.5 0.555 . . . . 0.0 112.5 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 75.7 p -101.41 -25.39 13.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.887 0.375 . . . . 0.0 110.762 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.443 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -51.33 137.99 28.91 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.691 -178.665 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.44 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 90.2 Cg_endo -99.41 31.25 11.35 Favored 'Cis proline' 0 N--CA 1.458 -0.567 0 C-N-CA 124.276 -1.135 . . . . 0.0 113.306 -0.11 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.23 154.44 38.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.764 0.316 . . . . 0.0 111.274 -178.269 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.63 ' HD2' HG13 ' A' ' 16' ' ' ILE . 61.4 mttp -80.01 134.55 36.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.075 179.472 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.458 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 80.8 mt -102.97 113.69 27.37 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.125 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.51 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 26.6 t -131.95 116.25 29.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.503 -178.206 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -78.87 111.99 15.58 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 174.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.616 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 86.4 t60 -91.61 77.27 5.68 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -177.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.473 HG23 ' O ' ' A' ' 127' ' ' THR . 10.4 t -83.63 92.08 7.59 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 122.328 1.061 . . . . 0.0 109.106 177.147 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -79.96 59.22 3.14 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.189 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -144.48 -51.55 0.29 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.584 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -153.67 128.91 9.75 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.184 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.575 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -76.76 105.47 7.84 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.068 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -151.03 -46.14 0.12 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 120.642 -0.423 . . . . 0.0 112.128 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.702 ' HB3' HD22 ' A' ' 145' ' ' LEU . 7.8 m95 -126.54 35.19 4.68 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -176.359 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -172.31 -123.1 0.69 Allowed Glycine 0 CA--C 1.506 -0.519 0 C-N-CA 119.237 -1.459 . . . . 0.0 112.87 -177.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.518 ' HB2' ' HA2' ' A' ' 139' ' ' GLY . 1.5 p-10 -107.13 -17.11 14.25 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.308 0.575 . . . . 0.0 109.576 176.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' GLY . . . . . 0.424 ' HA3' ' HB2' ' A' ' 131' ' ' ALA . . . 64.6 18.94 64.32 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.773 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.616 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 86.11 10.89 74.01 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.042 -0.599 . . . . 0.0 113.303 -179.438 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -163.72 23.08 0.08 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 117.453 0.627 . . . . 0.0 112.206 -178.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' GLY . . . . . 0.518 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 81.65 -49.82 4.13 Favored Glycine 0 CA--C 1.524 0.611 0 C-N-CA 120.86 -0.686 . . . . 0.0 113.703 176.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -81.14 60.24 4.2 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.642 0.734 . . . . 0.0 110.275 -175.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.575 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -125.31 15.41 7.25 Favored Glycine 0 C--N 1.317 -0.499 0 CA-C-N 115.277 -0.874 . . . . 0.0 113.495 -179.267 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 67.1 mttm 70.44 79.47 0.18 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.547 0.689 . . . . 0.0 111.006 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.81 5.34 2.61 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.084 -177.504 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.479 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 3.7 mmp_? -54.61 -29.96 53.32 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.592 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.702 HD22 ' HB3' ' A' ' 133' ' ' TRP . 54.2 tp -61.18 -49.91 75.29 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.051 0.453 . . . . 0.0 110.463 177.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.615 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -61.23 -32.51 80.9 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.973 177.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -72.9 -36.81 67.38 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.594 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.6 mt -59.43 -37.23 77.55 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.531 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.57 -39.89 94.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.663 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' MET . . . . . 0.615 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 52.9 mtt -64.73 -50.5 66.65 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.096 0.474 . . . . 0.0 110.275 177.265 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -60.42 -43.2 96.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.933 -178.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.518 HD11 ' HG3' ' A' ' 102' ' ' ARG . 44.8 tp -65.24 -40.84 94.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.462 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.443 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 51.6 ttp85 -56.69 -44.67 81.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.771 178.123 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 154' ' ' GLU . . . . . 0.495 ' O ' HG13 ' A' ' 158' ' ' ILE . 26.2 tt0 -71.78 -36.05 70.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.521 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 58.3 tp60 -61.66 -43.12 99.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.089 0.471 . . . . 0.0 110.292 176.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.702 HD13 ' HG3' ' A' ' 112' ' ' ARG . 93.1 mt -71.56 -29.83 65.18 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.55 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.433 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -63.42 -38.67 92.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.375 176.124 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 154' ' ' GLU . 75.1 mt -57.97 -43.26 84.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.56 176.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -61.44 -40.21 93.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.169 177.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -71.87 -23.25 61.48 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.749 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 161' ' ' LEU . . . . . 0.433 HD13 ' O ' ' A' ' 157' ' ' ALA . 5.0 mp -79.09 -40.54 30.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.191 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 . . . . . 0 C--N 1.325 -0.498 0 CA-C-O 121.089 0.471 . . . . 0.0 110.631 177.725 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 120.733 0.301 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -87.24 89.63 8.06 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.412 ' O ' HD13 ' A' ' 114' ' ' LEU . . . -92.43 -67.26 0.87 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.078 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.45 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -177.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 . . . . . 0 N--CA 1.456 -0.175 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.541 HG21 ' HD2' ' A' ' 120' ' ' PRO . 5.7 m -72.0 135.43 27.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.051 0.453 . . . . 0.0 110.636 175.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.59 14.06 1.8 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.83 -176.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 69.77 159.54 0.19 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.468 0.707 . . . . 0.0 111.053 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 51.03 29.72 4.8 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.382 0.611 . . . . 0.0 110.99 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.4 m -86.87 124.28 32.92 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.281 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 56.3 mt -110.66 115.48 49.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 169.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.2 mt -89.81 106.16 16.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.233 0.539 . . . . 0.0 110.286 -176.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.6 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 8.0 t-20 -106.65 126.86 52.82 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.591 -177.871 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.455 ' O ' ' HG3' ' A' ' 125' ' ' GLU . 27.2 p90 -128.78 -175.15 3.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.912 -178.418 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -142.19 104.72 4.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.11 -177.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 79.7 p 53.92 -166.33 0.08 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.622 0.769 . . . . 0.0 112.207 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.712 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 0.2 OUTLIER -81.71 -59.45 2.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.998 0.428 . . . . 0.0 110.232 178.66 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t 59.26 -96.34 0.06 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.444 175.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -144.24 -67.91 0.33 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.016 0.436 . . . . 0.0 111.732 -175.096 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -81.05 -79.4 0.16 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -165.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -88.92 -1.76 58.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.192 0.52 . . . . 0.0 111.532 -171.188 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.712 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -66.82 -0.63 9.1 Favored Glycine 0 CA--C 1.52 0.387 0 CA-C-N 116.019 -0.537 . . . . 0.0 114.231 -175.199 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -50.68 -32.1 18.31 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 117.332 0.566 . . . . 0.0 111.96 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -72.58 -12.54 61.1 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 98.6 p -77.3 126.89 31.65 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.843 177.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -51.15 -23.18 3.03 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -175.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.49 ' CZ ' ' HB2' ' A' ' 71' ' ' PRO . 54.1 t80 -62.4 -62.38 1.79 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 174.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.605 ' HA ' HG21 ' A' ' 22' ' ' THR . . . 32.26 -149.7 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.272 1.029 . . . . 0.0 113.753 -176.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -166.24 66.2 0.11 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.407 177.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.503 ' O ' ' HA ' ' A' ' 46' ' ' THR . 94.6 m95 -131.1 121.65 18.83 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.629 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.52 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 19.2 Cg_endo -59.4 126.55 21.08 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.854 2.37 . . . . 0.0 112.515 178.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.2 pt -119.86 157.74 22.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.155 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -119.42 95.34 4.75 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -177.415 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 t -131.09 142.31 43.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.174 -0.467 . . . . 0.0 109.971 -176.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.8 t70 67.14 17.06 10.35 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.817 0.818 . . . . 0.0 109.58 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 72.19 22.23 78.94 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.353 -174.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.3 tppt? -121.82 149.92 42.64 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -176.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.7 m -94.95 113.51 25.23 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.872 0.368 . . . . 0.0 110.156 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.52 ' O ' ' HA ' ' A' ' 36' ' ' PRO . 41.6 m95 -109.89 123.47 36.17 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.455 ' O ' ' HB ' ' A' ' 46' ' ' THR . 39.8 Cg_exo -58.94 -11.9 13.65 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 123.053 2.502 . . . . 0.0 113.794 -177.711 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 35' ' ' TRP . 8.9 t 177.57 170.11 0.63 Allowed 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 174.649 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -40.59 88.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -175.172 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -48.17 -42.57 30.08 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.195 0.31 . . . . 0.0 111.785 176.252 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -64.64 -41.86 95.85 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.181 -176.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -69.95 -43.52 71.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.215 0.531 . . . . 0.0 110.179 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.444 ' HA ' HG11 ' A' ' 96' ' ' VAL . 89.5 t80 -61.26 -42.36 98.5 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.497 178.301 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.667 ' HG3' HD13 ' A' ' 65' ' ' ILE . 5.3 tp-100 -68.83 -45.56 70.84 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.885 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.487 ' HB1' ' CG ' ' A' ' 62' ' ' ARG . . . -65.9 -47.43 74.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.762 -177.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -75.23 -13.69 60.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.569 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.526 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.9 ttmp? -59.23 -33.19 70.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.077 0.465 . . . . 0.0 110.532 171.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.546 ' CE1' ' HG3' ' A' ' 83' ' ' LYS . 56.9 m-85 -107.32 166.99 10.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.971 -176.522 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.741 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.5 pt? -115.08 11.37 16.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.043 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -97.15 123.22 40.85 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.225 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.15 -40.13 86.64 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.101 -173.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -60.21 -53.77 53.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.923 0.392 . . . . 0.0 110.348 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 65' ' ' ILE . 3.1 t80 -66.44 -32.81 74.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.592 -177.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.487 ' CG ' ' HB1' ' A' ' 53' ' ' ALA . 44.4 ttm-85 -60.6 -49.41 77.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.019 0.437 . . . . 0.0 110.313 178.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -78.4 -15.15 58.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.109 0.48 . . . . 0.0 110.354 -178.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -74.66 -40.31 61.51 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.667 HD13 ' HG3' ' A' ' 52' ' ' GLN . 72.0 mt -70.39 -25.81 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.124 174.669 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.07 -22.06 53.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.854 174.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 73.4 ttt-85 -80.99 -29.97 35.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.958 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.511 HG21 ' HB ' ' A' ' 73' ' ' VAL . 14.9 p -75.8 126.61 36.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.235 0.54 . . . . 0.0 110.736 -179.005 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m -74.44 -41.75 60.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.506 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.466 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 30.2 t -69.09 130.05 91.63 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.069 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.49 ' HB2' ' CZ ' ' A' ' 32' ' ' PHE . 7.2 Cg_exo -73.45 -26.07 14.6 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.592 2.194 . . . . 0.0 111.322 174.203 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.5 tpt -70.44 -43.27 70.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.321 -177.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.511 ' HB ' HG21 ' A' ' 68' ' ' VAL . 59.8 t -63.84 -34.09 66.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.048 177.366 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.14 -49.53 74.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.472 177.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.542 ' HA ' HE21 ' A' ' 52' ' ' GLN . . . -60.16 -37.42 80.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.551 177.459 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -62.08 -33.93 75.34 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.758 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.522 ' SD ' HG12 ' A' ' 65' ' ' ILE . 56.1 mtt -65.72 -50.69 63.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.131 0.491 . . . . 0.0 111.473 -179.675 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.608 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -94.3 4.42 70.32 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.29 -0.957 . . . . 0.0 113.568 -174.186 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 5.3 tpp180 -71.24 -25.13 62.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.908 0.354 . . . . 0.0 111.211 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -99.37 131.97 45.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.152 0.501 . . . . 0.0 109.701 177.448 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.5 mtm180 -101.35 29.88 4.52 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.397 -172.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.4 p -82.7 19.73 1.27 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.574 0.702 . . . . 0.0 109.935 174.211 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.546 ' HG3' ' CE1' ' A' ' 56' ' ' PHE . 41.1 mmtm -89.22 169.72 12.36 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.703 178.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 16.8 Cg_endo -60.14 -29.13 88.42 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.332 2.021 . . . . 0.0 111.537 170.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.7 mt 67.72 -174.06 0.19 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.129 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.467 ' HB3' ' HB2' ' A' ' 89' ' ' TRP . 57.0 ttt-85 -134.18 142.27 47.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.811 -176.201 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -64.37 -68.41 0.36 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.799 -175.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -81.96 25.94 0.54 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.411 -174.141 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.489 ' CZ2' ' HE3' ' A' ' 55' ' ' LYS . 58.5 t-105 -61.0 -33.11 72.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.117 0.484 . . . . 0.0 110.104 177.294 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.415 ' O ' ' HE3' ' A' ' 93' ' ' LYS . 40.3 tt0 -55.92 -35.78 66.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.071 -178.371 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.1 p -99.93 -8.52 23.88 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -173.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.487 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.7 m -108.74 1.81 9.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -175.417 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.487 ' HB2' ' HZ2' ' A' ' 93' ' ' LYS . 10.0 mtmp? -54.92 -57.69 10.63 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.593 0.711 . . . . 0.0 110.49 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.543 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 1.9 pm0 -78.14 -14.94 59.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.134 -178.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.551 ' O ' ' HD3' ' A' ' 99' ' ' LYS . 34.0 tt0 -73.11 -52.37 14.5 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 176.488 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.444 HG11 ' HA ' ' A' ' 51' ' ' PHE . 96.8 t -58.44 -41.41 81.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.996 177.121 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 mmt -60.46 -39.0 86.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.281 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 38.1 ttm-85 -61.56 -38.45 87.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.524 0.202 . . . . 0.0 111.105 -178.265 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.551 ' HD3' ' O ' ' A' ' 95' ' ' GLN . 0.3 OUTLIER -71.03 -48.17 54.46 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.916 0.388 . . . . 0.0 110.805 176.23 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.2 -42.86 99.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.466 -177.269 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.6 -38.56 84.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.182 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 52.1 ttt180 -63.3 -48.17 79.2 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.06 178.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 107' ' ' GLN . . . -59.02 -38.01 78.26 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.981 0.419 . . . . 0.0 110.408 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.436 ' HZ3' HD13 ' A' ' 111' ' ' LEU . 60.4 tttm -62.11 -52.37 64.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.323 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.517 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 68.5 m-85 -81.96 -41.66 20.49 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -174.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -75.42 -39.59 58.76 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 121.969 -0.457 . . . . 0.0 111.197 -173.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.414 ' HB3' ' O ' ' A' ' 103' ' ' ALA . 29.4 tt0 -74.63 -31.19 61.91 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.796 0.331 . . . . 0.0 110.662 -178.238 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -100.21 97.55 8.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.31 66.04 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -171.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.472 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.7 pm0 -68.14 -32.45 72.74 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.038 -178.723 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.436 HD13 ' HZ3' ' A' ' 104' ' ' LYS . 42.4 mt -74.34 -37.15 63.61 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.35 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.584 ' HG3' HD13 ' A' ' 156' ' ' LEU . 24.5 ttm180 -58.23 -50.26 74.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.121 177.04 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.95 -39.88 95.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.724 -179.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.412 HD13 ' O ' ' A' ' 5' ' ' ALA . 58.6 tp -59.46 -48.83 80.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.583 177.267 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 44.1 tp -62.93 -39.61 95.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.993 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.423 HD21 ' HB2' ' A' ' 156' ' ' LEU . 80.5 mt -76.61 -15.03 59.94 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -82.97 -18.18 40.84 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.71 0.291 . . . . 0.0 111.159 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 66.2 p -72.44 -35.01 68.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.031 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.66 138.47 16.87 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.793 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.541 ' HD2' HG21 ' A' ' 11' ' ' VAL . 43.1 Cg_endo -95.72 29.16 15.96 Favored 'Cis proline' 0 CA--C 1.533 0.458 0 C-N-CA 124.147 -1.189 . . . . 0.0 113.657 1.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.19 153.32 43.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.88 0.372 . . . . 0.0 111.354 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -92.29 134.81 34.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.261 -177.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 40.1 mt -98.5 109.45 22.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.88 0.372 . . . . 0.0 110.708 -177.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.6 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 91.2 t -139.41 122.72 18.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.447 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 19' ' ' PHE . 87.6 tt0 -101.31 118.19 36.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.088 0.47 . . . . 0.0 110.77 176.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' HIS . . . . . 0.79 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 57.4 t60 -89.92 81.76 6.25 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 173.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 14.5 t -120.86 143.52 48.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.304 -178.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -118.56 9.03 12.14 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.403 0.62 . . . . 0.0 109.808 175.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -62.24 -33.33 74.38 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.468 176.187 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -155.52 119.0 4.41 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.472 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -80.73 85.51 6.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.225 0.536 . . . . 0.0 110.787 -175.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.666 ' HA ' ' O ' ' A' ' 141' ' ' GLY . 40.2 t80 179.01 153.03 0.38 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.559 -1.2 . . . . 0.0 107.911 173.144 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.645 ' O ' ' HB3' ' A' ' 145' ' ' LEU . 84.1 m95 78.73 -19.19 0.46 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.557 0.743 . . . . 0.0 111.537 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' A' ' 143' ' ' ASN . . . -138.04 -152.82 6.12 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.373 -174.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.79 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 20.4 t70 -67.46 -24.86 65.65 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.156 0.503 . . . . 0.0 110.802 178.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 136' ' ' GLY . . . . . 0.536 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 72.51 8.32 71.09 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.506 178.357 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 88.17 -10.66 70.13 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.408 -0.425 . . . . 0.0 113.103 178.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' HIS . . . . . 0.605 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 24.9 p80 -160.63 30.12 0.16 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.928 0.364 . . . . 0.0 111.625 -173.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 84.35 -51.37 4.55 Favored Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.813 -0.708 . . . . 0.0 113.191 177.412 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.605 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 53.1 mttp -75.49 55.4 0.81 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.073 0.463 . . . . 0.0 111.676 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.666 ' O ' ' HA ' ' A' ' 132' ' ' TYR . . . -123.7 -4.84 7.91 Favored Glycine 0 C--O 1.223 -0.576 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.0 176.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.405 ' C ' ' H ' ' A' ' 144' ' ' ARG . 2.9 mptp? 61.4 84.2 0.14 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.962 0.381 . . . . 0.0 111.722 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' ASN . . . . . 0.437 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 8.0 t30 -68.08 5.73 0.87 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.412 1.085 . . . . 0.0 111.597 -178.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.405 ' H ' ' C ' ' A' ' 142' ' ' LYS . 14.0 tpt180 -33.06 -31.05 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.542 1.137 . . . . 0.0 113.276 176.177 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.645 ' HB3' ' O ' ' A' ' 133' ' ' TRP . 25.5 tp -68.23 -49.23 62.12 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 117.944 0.338 . . . . 0.0 110.957 -179.268 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -61.47 -32.54 81.51 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.251 -0.74 . . . . 0.0 111.251 177.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -69.01 -43.25 75.17 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 175.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.5 -48.79 76.44 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.439 175.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.82 -42.08 88.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.892 178.278 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 73.1 mtm -69.04 -37.46 78.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.331 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -60.57 -51.63 68.59 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.705 0.288 . . . . 0.0 110.253 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 64.3 tp -60.11 -43.07 95.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.416 178.61 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.441 HH21 ' HA ' ' A' ' 120' ' ' PRO . 2.4 ttt-85 -51.85 -56.95 10.92 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.676 177.352 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 154' ' ' GLU . . . . . 0.472 ' O ' HG13 ' A' ' 158' ' ' ILE . 35.8 mt-10 -72.86 -22.98 60.69 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.213 -178.598 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -68.57 -39.14 81.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.222 174.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.584 HD13 ' HG3' ' A' ' 112' ' ' ARG . 96.0 mt -67.93 -31.25 70.87 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.108 0.48 . . . . 0.0 109.892 179.017 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.575 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -67.38 -46.08 74.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.34 175.067 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 154' ' ' GLU . 85.2 mt -65.72 -34.39 70.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -59.67 -34.35 72.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.303 0.573 . . . . 0.0 109.943 175.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -79.14 -18.81 52.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.667 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 161' ' ' LEU . . . . . 0.575 HD13 ' O ' ' A' ' 157' ' ' ALA . 6.1 mp -78.43 -25.06 45.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.114 0.483 . . . . 0.0 110.619 176.807 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.324 178.327 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.5 tmm? . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -96.9 115.2 0.13 Allowed 'Trans proline' 0 N--CA 1.447 -1.229 0 C-N-CA 123.333 2.689 . . . . 0.0 112.661 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.4 t -76.37 84.77 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 175.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -131.12 153.83 48.96 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.657 -176.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.51 136.15 42.2 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 163.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.586 ' HB3' ' HA ' ' A' ' 9' ' ' GLN . 73.7 mm-40 66.97 69.41 0.4 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.656 0.597 . . . . 0.0 110.538 -173.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -58.11 -53.48 57.79 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 174.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 66.8 mt -100.8 107.53 21.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 164.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.586 ' HA ' ' HB3' ' A' ' 6' ' ' GLN . 76.8 mt-30 -61.25 94.12 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 O-C-N 123.693 0.621 . . . . 0.0 110.677 -175.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.6 t60 60.64 98.7 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.123 0 O-C-N 123.968 0.792 . . . . 0.0 110.432 -174.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -61.53 168.85 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 111.09 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.456 ' O ' ' HB2' ' A' ' 13' ' ' GLN . 4.5 mtt -64.09 -85.5 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.215 -174.014 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' MET . 51.8 tt0 169.89 120.49 0.01 OUTLIER 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.759 -177.052 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 65.03 26.16 12.62 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.24 0.543 . . . . 0.0 110.509 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.47 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 29.3 m -76.87 110.97 11.92 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.299 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.9 mm -77.35 108.36 10.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.9 mt -95.82 99.32 9.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.764 -177.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -90.75 106.67 18.67 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 173.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -117.47 132.8 56.49 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.036 -175.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -150.48 100.36 2.86 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.773 167.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.409 ' HB3' ' OD2' ' A' ' 24' ' ' ASP . 6.9 m 177.89 88.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 O-C-N 124.065 0.853 . . . . 0.0 109.458 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.701 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 1.3 m -79.87 2.63 22.55 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.994 0.426 . . . . 0.0 111.473 -174.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.1 m -91.42 -8.32 48.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.706 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.409 ' OD2' ' HB3' ' A' ' 21' ' ' SER . 4.1 p30 -131.18 -165.5 1.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.305 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -65.7 -26.46 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.364 -172.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -80.38 -2.49 45.75 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.92 0.39 . . . . 0.0 111.034 177.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.701 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -83.26 -16.84 68.19 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.728 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -68.25 -26.64 65.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.071 0.462 . . . . 0.0 110.898 -179.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -69.28 -26.17 64.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.31 178.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.3 m -76.08 126.76 31.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 171.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -60.46 -20.71 60.85 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -76.51 4.71 8.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.116 0.484 . . . . 0.0 111.225 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -66.75 131.46 46.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.749 0.309 . . . . 0.0 110.678 176.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.499 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -80.93 58.83 3.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.198 0.523 . . . . 0.0 111.681 -175.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -102.34 117.64 60.66 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.822 174.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.6 125.14 17.8 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.956 2.438 . . . . 0.0 112.556 -176.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.757 HG22 ' HA ' ' A' ' 104' ' ' LYS . 29.5 pt -114.4 139.34 40.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.299 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -102.54 105.09 15.55 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.441 HG22 ' CB ' ' A' ' 103' ' ' ALA . 4.0 t -128.57 123.12 58.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.263 -173.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 59.21 27.21 16.16 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.191 174.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.61 -5.62 57.01 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.563 -0.827 . . . . 0.0 113.433 175.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.519 ' HD3' ' HD2' ' A' ' 66' ' ' ARG . 60.9 mttm -124.05 156.9 35.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 117.596 0.698 . . . . 0.0 111.373 -178.468 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.1 m -100.54 117.04 33.88 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.266 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.489 ' HB2' HG13 ' A' ' 37' ' ' ILE . 41.1 m95 -105.86 133.92 19.98 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.431 -179.118 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 43.8 Cg_exo -58.43 -41.27 67.17 Favored 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 122.66 2.24 . . . . 0.0 112.752 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.499 HG22 ' HA ' ' A' ' 34' ' ' ALA . 77.9 p -148.24 172.14 14.82 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -33.49 75.18 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -177.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.592 ' H ' ' CD ' ' A' ' 48' ' ' GLU . 3.6 mp0 -61.3 -28.55 69.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.947 0.403 . . . . 0.0 110.904 -177.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.419 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 57.1 m80 -65.91 -48.01 72.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.401 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -72.75 -35.99 67.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.335 0.588 . . . . 0.0 109.758 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -59.58 -49.1 79.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.028 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.434 ' HA ' ' CB ' ' A' ' 55' ' ' LYS . 37.2 mt-30 -85.97 -13.31 48.02 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.682 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.479 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -69.43 -30.43 68.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.26 0.552 . . . . 0.0 109.961 173.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -90.8 -21.76 21.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.649 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.434 ' CB ' ' HA ' ' A' ' 52' ' ' GLN . 83.0 tttt -58.12 -53.31 59.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.2 0.524 . . . . 0.0 110.606 176.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -91.56 142.05 28.05 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.75 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.759 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.4 pt? -98.5 10.13 41.62 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 173.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.4 ' HB2' ' HB3' ' A' ' 61' ' ' TYR . 33.7 m-20 -67.51 112.34 4.63 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.762 174.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -50.98 -61.82 1.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.022 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -77.16 -18.27 57.96 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.866 -171.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.543 ' O ' HG13 ' A' ' 65' ' ' ILE . 3.9 t80 -80.58 -35.64 33.95 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.479 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 33.5 ttm180 -59.21 -44.44 92.26 Favored 'General case' 0 CA--C 1.521 -0.144 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 173.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.42 -39.72 76.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.495 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.441 ' CD ' HH21 ' A' ' 67' ' ' ARG . 7.8 tp10 -63.0 -49.24 75.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.916 0.389 . . . . 0.0 110.682 177.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.543 HG13 ' O ' ' A' ' 61' ' ' TYR . 3.5 mt -70.19 -22.78 24.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.185 0.517 . . . . 0.0 110.877 -177.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.519 ' HD2' ' HD3' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -78.46 -29.27 46.77 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.211 176.891 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.441 HH21 ' CD ' ' A' ' 64' ' ' GLU . 56.5 ttp180 -86.02 -35.44 20.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.638 -175.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.4 p -65.43 117.4 6.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.474 0.654 . . . . 0.0 111.22 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.2 m -77.14 -33.72 56.66 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.593 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.3 m -66.24 126.55 92.2 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.335 -178.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.419 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 54.4 Cg_endo -71.86 -40.64 2.56 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.828 2.352 . . . . 0.0 113.281 -179.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 87.0 mtp -70.29 -29.8 66.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.745 0.307 . . . . 0.0 110.74 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.519 ' O ' ' HG3' ' A' ' 77' ' ' MET . 99.6 t -66.74 -39.51 83.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.558 178.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.36 -39.36 90.33 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 120.92 0.391 . . . . 0.0 110.369 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.64 -38.27 80.34 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.711 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -65.97 -57.36 8.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.954 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -83.26 -13.04 56.08 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.319 -0.553 . . . . 0.0 111.159 -176.58 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.34 -10.33 60.87 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.644 -0.788 . . . . 0.0 111.607 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.72 -40.46 66.09 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 122.742 0.417 . . . . 0.0 111.647 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.456 ' OD2' ' HG3' ' A' ' 83' ' ' LYS . 30.3 t70 -59.73 137.47 58.03 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.015 -170.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 87.1 mtm-85 -116.96 18.54 14.67 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.059 176.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.4 m -90.91 -28.96 17.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.663 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.456 ' HG3' ' OD2' ' A' ' 80' ' ' ASP . 6.1 mtpm? -63.31 156.69 68.26 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.257 176.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.05 113.62 1.66 Allowed 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.43 2.087 . . . . 0.0 111.786 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 67.0 mt -101.04 163.75 12.14 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.485 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.443 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 23.6 mtp180 -67.26 139.27 57.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.842 0.353 . . . . 0.0 110.446 176.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 43.2 mtpt -60.64 -28.41 68.54 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.495 0.664 . . . . 0.0 110.604 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -104.07 12.96 33.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.413 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.493 ' HA ' HG22 ' A' ' 92' ' ' VAL . 50.3 t-105 -59.98 -33.65 72.24 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.534 -176.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.66 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 18.3 mm-40 -65.65 -24.32 67.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.398 -179.143 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.3 t -99.68 -44.78 5.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.299 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.7 m -73.96 3.01 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -170.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.66 ' NZ ' ' HA ' ' A' ' 90' ' ' GLU . 56.7 mttp -56.79 -42.35 79.32 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 175.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.498 ' O ' ' HB2' ' A' ' 98' ' ' ARG . 52.1 mt-10 -61.13 -39.5 90.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.833 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -69.19 -50.88 43.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.368 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 59.6 t -63.78 -49.37 82.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.776 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.498 ' SD ' HD13 ' A' ' 145' ' ' LEU . 50.7 ttm -66.2 -36.06 82.08 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.335 -177.297 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' A' ' 94' ' ' GLU . 20.3 ttt180 -61.31 -43.16 99.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.832 0.349 . . . . 0.0 110.664 -179.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -70.51 -35.34 73.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.572 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.88 88.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.732 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.468 HD11 HD12 ' A' ' 145' ' ' LEU . 94.0 mt -64.46 -40.3 95.44 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.53 176.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.497 ' O ' ' HB2' ' A' ' 106' ' ' GLU . 34.2 ttm180 -54.17 -54.46 39.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.1 175.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.441 ' CB ' HG22 ' A' ' 39' ' ' VAL . . . -62.05 -34.43 76.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.457 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.757 ' HA ' HG22 ' A' ' 37' ' ' ILE . 64.4 tttm -63.96 -56.1 17.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.249 -178.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.497 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 71.2 m-85 -78.38 -28.0 46.96 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -175.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -79.02 -40.58 31.04 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.09 -177.464 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -69.61 -14.67 62.95 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.05 0.452 . . . . 0.0 110.884 -176.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -124.98 105.97 9.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.359 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -56.67 -31.43 64.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.96 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.05 -47.41 81.03 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.964 177.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 36.0 mt -74.49 -39.85 62.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.763 -175.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.589 ' HG3' HD13 ' A' ' 156' ' ' LEU . 61.9 ttt180 -59.12 -48.45 81.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.451 178.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.8 -35.14 80.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.553 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 62.2 tp -64.61 -37.15 86.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.61 176.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.471 ' HG ' ' HB2' ' A' ' 153' ' ' ARG . 16.5 tp -64.02 -50.52 68.14 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.099 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.506 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 4.6 mp -67.44 -19.71 65.4 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.82 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -67.67 -30.15 69.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.511 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.445 ' HB ' HD21 ' A' ' 123' ' ' LEU . 70.0 p -81.3 -0.46 41.06 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 120.758 0.313 . . . . 0.0 111.683 -177.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.541 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -86.33 139.94 34.17 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 170.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.433 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 73.7 Cg_endo -99.11 74.67 0.14 OUTLIER 'Cis proline' 0 N--CA 1.454 -0.799 0 C-N-CA 124.468 -1.055 . . . . 0.0 113.291 -0.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.47 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -111.0 176.4 5.04 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -120.83 120.53 35.83 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.996 0.426 . . . . 0.0 110.272 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.445 HD21 ' HB ' ' A' ' 118' ' ' THR . 9.1 mt -86.32 125.85 33.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.787 -173.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.2 t -130.83 116.85 35.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.845 0.355 . . . . 0.0 110.925 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -79.99 130.48 35.31 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 175.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.633 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 10.6 t60 -125.64 77.47 1.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.188 0.518 . . . . 0.0 109.613 -173.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 5.0 t -87.2 114.23 23.63 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.543 0.687 . . . . 0.0 109.319 175.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.711 ' OE2' ' HA3' ' A' ' 137' ' ' GLY . 5.6 tp10 -82.17 41.32 0.67 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.616 0.722 . . . . 0.0 109.378 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -143.06 -75.79 0.26 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.375 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -118.42 95.35 4.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.068 -174.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.35 86.08 2.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.165 -177.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.448 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 28.7 t80 -151.08 122.06 7.65 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.606 ' O ' ' HB3' ' A' ' 145' ' ' LEU . 71.3 m95 74.73 -10.34 1.2 Allowed 'General case' 0 N--CA 1.474 0.737 0 O-C-N 124.016 0.823 . . . . 0.0 110.585 -171.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.569 ' O ' ' HA3' ' A' ' 141' ' ' GLY . . . -137.79 136.99 8.54 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 108.196 -1.962 . . . . 0.0 108.196 176.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.561 ' HB2' ' HB2' ' A' ' 143' ' ' ASN . 1.4 t70 -68.82 1.77 3.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.697 0.749 . . . . 0.0 112.109 -166.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 68.85 -164.53 49.32 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.933 175.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.711 ' HA3' ' OE2' ' A' ' 128' ' ' GLU . . . -89.98 -17.02 55.13 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.924 178.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -99.63 -16.92 18.05 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 89.08 62.07 1.38 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.118 -1.039 . . . . 0.0 112.468 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 56.4 tttm 176.84 65.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 176.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.569 ' HA3' ' O ' ' A' ' 134' ' ' GLY . . . -124.67 4.62 8.61 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.176 -1.012 . . . . 0.0 113.441 -173.014 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.438 ' C ' ' H ' ' A' ' 144' ' ' ARG . 55.0 mttp 64.19 53.71 1.73 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.122 0.486 . . . . 0.0 109.895 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.561 ' HB2' ' HB2' ' A' ' 135' ' ' ASP . 7.4 t30 -57.15 5.1 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.368 1.467 . . . . 0.0 113.791 -177.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.533 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 57.9 mtm180 -51.84 -13.28 0.26 Allowed 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.606 ' HB3' ' O ' ' A' ' 133' ' ' TRP . 25.4 tp -60.57 -49.84 75.94 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 171.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.653 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -62.92 -33.03 85.98 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.555 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -68.82 -41.21 78.93 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 121.165 -0.214 . . . . 0.0 110.638 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 88.7 mt -58.05 -37.13 73.82 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.83 -38.07 89.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.914 175.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.653 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 38.5 mtt -66.35 -50.28 64.08 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.183 0.516 . . . . 0.0 110.189 178.535 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 23.0 tt0 -69.38 -35.95 76.31 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.608 -176.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 102' ' ' ARG . 50.9 tp -62.07 -43.92 97.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.041 0.448 . . . . 0.0 109.859 174.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.541 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 47.5 ttp85 -55.51 -41.54 73.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.969 176.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.503 ' O ' HG13 ' A' ' 158' ' ' ILE . 31.6 tt0 -68.36 -34.71 76.57 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.684 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' ' 151' ' ' GLU . 15.3 mt-30 -65.35 -41.85 93.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.068 0.461 . . . . 0.0 109.858 176.034 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.589 HD13 ' HG3' ' A' ' 112' ' ' ARG . 94.3 mt -67.27 -28.88 68.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.086 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -69.44 -40.95 76.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.453 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 154' ' ' GLU . 76.2 mt -60.63 -46.06 96.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.669 0.271 . . . . 0.0 110.474 178.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' GLU . . . . . 0.49 ' CD ' HH22 ' A' ' 112' ' ' ARG . 0.2 OUTLIER -61.3 -38.45 86.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.07 0.462 . . . . 0.0 110.088 177.381 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -70.33 -33.31 71.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.477 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 4.6 mp -68.63 -10.62 57.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.132 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -83.7 10.26 9.74 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.426 174.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -53.81 106.7 0.2 Allowed 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 121.692 0.758 . . . . 0.0 111.952 176.028 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -154.8 86.36 1.12 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 176.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.01 143.47 29.47 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.072 -174.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -79.15 75.83 5.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.117 -176.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 33.9 m-70 -160.08 -39.65 0.05 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.218 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 . . . . . 0 C--O 1.244 0.78 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.083 179.775 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 ptt? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -84.58 105.57 1.03 Allowed 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 122.785 2.324 . . . . 0.0 112.85 -177.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.779 HG22 ' H ' ' A' ' 5' ' ' ALA . 2.5 p -137.95 -65.93 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.926 177.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.68 ' H ' HG13 ' A' ' 3' ' ' VAL . 7.2 tpp85 56.84 25.73 10.73 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.74 0.781 . . . . 0.0 111.586 178.007 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.779 ' H ' HG22 ' A' ' 3' ' ' VAL . . . -69.32 127.87 34.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 173.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -66.2 -41.81 89.66 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.946 -176.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 64.82 171.1 0.2 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.505 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.416 HD11 ' HA ' ' A' ' 118' ' ' THR . 25.8 pt -135.85 150.68 28.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.762 175.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -72.91 -38.75 66.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.111 0.481 . . . . 0.0 110.169 177.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -165.34 171.55 13.34 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.89 179.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.728 HG21 ' HD2' ' A' ' 120' ' ' PRO . 34.1 m -93.74 175.19 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 174.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 51.4 mtm -108.95 37.22 2.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.312 -178.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.403 ' H ' HG23 ' A' ' 11' ' ' VAL . 52.2 tt0 63.83 102.56 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.952 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.3 t70 49.95 79.84 0.08 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.528 -175.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.8 m -103.66 127.41 51.1 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.713 -178.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 48.5 mt -96.67 107.13 19.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 CA-C-O 121.446 0.641 . . . . 0.0 110.074 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -89.89 96.96 6.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.24 -176.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -83.51 101.34 11.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.362 174.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.447 ' O ' ' HA ' ' A' ' 125' ' ' GLU . 52.5 p90 -116.19 148.93 39.89 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.781 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.44 ' HB2' ' HB3' ' A' ' 126' ' ' HIS . 34.9 t80 -150.23 150.3 31.38 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.388 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 96.1 p 62.48 159.52 0.07 Allowed 'General case' 0 C--O 1.231 0.113 0 O-C-N 124.867 1.354 . . . . 0.0 111.661 177.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.498 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 7.8 p -83.14 -65.99 0.94 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.528 175.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.1 t 61.41 -78.88 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.205 0 O-C-N 124.135 0.897 . . . . 0.0 111.625 176.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -105.9 -169.08 1.53 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.901 0.381 . . . . 0.0 110.117 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -66.02 -31.93 73.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.749 -174.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -75.99 -1.59 26.44 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.309 0.576 . . . . 0.0 111.187 -175.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.498 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -68.53 -0.32 16.93 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.109 174.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -52.36 -32.47 38.55 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.602 0.761 . . . . 0.0 112.642 -177.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -60.1 -36.49 77.53 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.7 t -59.97 148.86 33.74 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.133 0.492 . . . . 0.0 111.04 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -74.5 -14.64 60.84 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.096 0.474 . . . . 0.0 109.928 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -96.84 7.9 45.57 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.31 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.475 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -70.69 136.06 48.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.715 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -83.12 64.6 7.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.608 0.718 . . . . 0.0 110.939 -174.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.414 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 70.4 m95 -108.86 120.97 44.46 Favored Pre-proline 0 C--N 1.314 -0.957 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.048 172.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 34.5 Cg_exo -60.49 133.45 48.97 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.985 2.457 . . . . 0.0 112.518 -177.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.482 HD13 ' HA ' ' A' ' 47' ' ' SER . 39.0 pt -118.81 147.91 22.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.967 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -109.04 98.62 8.06 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.414 ' CG1' ' HE2' ' A' ' 99' ' ' LYS . 21.2 t -122.02 120.37 61.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.913 -174.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 61.57 27.8 17.19 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.593 0.558 . . . . 0.0 110.629 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.39 0.57 90.12 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 121.034 -0.603 . . . . 0.0 112.462 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -104.63 144.4 31.76 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -177.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.1 m -105.29 109.07 20.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.924 0.392 . . . . 0.0 110.674 -175.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.41 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 62.4 m95 -102.05 143.84 27.41 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.713 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 32.4 Cg_exo -59.24 -30.48 93.07 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.939 2.426 . . . . 0.0 112.248 179.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.748 HG23 ' OE1' ' A' ' 48' ' ' GLU . 2.3 t -170.76 -179.93 3.01 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.882 177.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.482 ' HA ' HD13 ' A' ' 37' ' ' ILE . 20.3 m -66.62 -39.62 88.41 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 113.369 0.878 . . . . 0.0 113.369 -166.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.748 ' OE1' HG23 ' A' ' 46' ' ' THR . 0.6 OUTLIER -63.15 -33.99 76.65 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.498 -171.954 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -56.01 -42.99 77.3 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.609 0.242 . . . . 0.0 111.072 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -71.46 -39.63 70.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.99 0.424 . . . . 0.0 110.24 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -60.63 -38.37 84.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.151 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.1 mm100 -72.87 -46.47 52.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.424 177.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.657 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -61.4 -42.18 98.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.705 -179.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -84.8 -13.66 50.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.764 -176.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.591 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.8 ttmp? -64.35 -53.14 53.31 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.86 0.362 . . . . 0.0 110.612 173.202 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.444 ' HE1' ' HB2' ' A' ' 83' ' ' LYS . 92.9 m-85 -80.66 160.22 25.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.12 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.494 HD11 ' HB3' ' A' ' 86' ' ' ARG . 5.5 mp -98.89 -28.84 13.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.645 177.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -58.85 120.57 9.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.06 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -68.72 -37.45 79.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -61.27 -42.74 99.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.417 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.423 ' O ' HG13 ' A' ' 65' ' ' ILE . 0.2 OUTLIER -74.14 -37.28 64.09 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.68 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.657 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.5 ttm180 -62.58 -41.56 99.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.397 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.522 ' HG2' ' NH1' ' A' ' 67' ' ' ARG . 16.5 tt0 -71.04 -26.93 63.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.025 178.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -68.09 -40.46 82.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.851 175.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.516 HG12 ' SD ' ' A' ' 77' ' ' MET . 56.6 mt -71.89 -18.52 19.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.283 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -75.38 -24.65 57.27 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.522 ' NH1' ' HG2' ' A' ' 63' ' ' GLU . 35.8 mmt-85 -73.37 -36.08 66.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.999 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.467 HG21 ' HB ' ' A' ' 73' ' ' VAL . 14.9 p -75.39 125.39 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.638 0.733 . . . . 0.0 112.038 -171.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.2 p -91.4 -38.78 12.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.392 176.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 20.0 m -72.57 121.04 83.84 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.513 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -52.52 -46.29 34.23 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.658 2.906 . . . . 0.0 113.519 179.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 85.1 mtp -63.81 -31.36 72.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.322 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.467 ' HB ' HG21 ' A' ' 68' ' ' VAL . 43.2 t -75.98 -32.29 23.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.808 0.337 . . . . 0.0 110.244 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.62 99.51 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.265 0.555 . . . . 0.0 110.462 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.23 -39.51 86.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.09 175.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -34.62 72.03 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.899 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.516 ' SD ' HG12 ' A' ' 65' ' ' ILE . 64.2 mtt -64.73 -55.04 22.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.061 0.458 . . . . 0.0 110.653 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.22 11.59 60.37 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.047 -0.597 . . . . 0.0 113.007 -176.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.54 -15.73 63.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.074 0.464 . . . . 0.0 110.372 174.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -107.18 114.03 27.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.439 177.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.638 ' HB2' HD11 ' A' ' 85' ' ' LEU . 26.1 ptt180 -101.16 24.93 8.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.783 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.4 m -81.08 -9.96 59.74 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.662 0.744 . . . . 0.0 109.223 174.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.444 ' HB2' ' HE1' ' A' ' 56' ' ' PHE . 46.8 mmtm -80.59 166.29 40.5 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.864 177.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -56.31 108.36 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.466 2.111 . . . . 0.0 113.126 -177.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.638 HD11 ' HB2' ' A' ' 81' ' ' ARG . 92.7 mt -91.8 148.85 21.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.824 175.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.494 ' HB3' HD11 ' A' ' 57' ' ' LEU . 11.6 ptp180 -84.26 150.01 25.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.04 0.448 . . . . 0.0 111.519 -175.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -75.27 -25.45 58.02 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.997 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -90.92 9.94 28.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.835 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.447 ' HB2' ' HG3' ' A' ' 86' ' ' ARG . 58.0 t-105 -56.27 -47.6 78.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.756 -174.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.4 -16.52 64.15 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -177.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.4 m -99.6 -30.45 12.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.89 0.376 . . . . 0.0 111.285 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 29.7 m -93.0 -0.08 10.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.668 0.27 . . . . 0.0 110.7 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -55.39 -57.95 9.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.195 0.522 . . . . 0.0 110.554 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -64.63 -40.62 95.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.984 177.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -63.49 -53.65 48.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.566 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 45.1 t -60.18 -49.27 84.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.072 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.1 tpt -65.94 -38.91 89.83 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.908 -174.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.511 ' HD3' HD22 ' A' ' 148' ' ' LEU . 31.8 mtm180 -73.5 -22.63 60.09 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.444 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.414 ' HE2' ' CG1' ' A' ' 39' ' ' VAL . 86.9 tttt -72.97 -38.37 66.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.015 0.436 . . . . 0.0 109.858 176.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.77 -42.38 67.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.473 176.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.459 HD22 HD21 ' A' ' 149' ' ' LEU . 61.7 mt -63.13 -42.98 99.6 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.008 177.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 102' ' ' ARG . 40.7 ttm180 -52.35 -53.0 50.3 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.768 175.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.422 ' CB ' ' HB ' ' A' ' 37' ' ' ILE . . . -55.36 -43.62 75.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.002 -176.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -63.0 -52.14 64.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.685 0.279 . . . . 0.0 111.013 -176.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -77.37 -28.59 52.93 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -79.64 -46.21 17.62 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 122.248 -0.282 . . . . 0.0 111.15 -175.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -66.58 -38.95 88.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.88 0.371 . . . . 0.0 110.767 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -101.96 100.27 10.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.437 178.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.406 ' HA ' ' HB2' ' A' ' 112' ' ' ARG . . . -61.92 -22.64 65.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.106 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.8 mp0 -56.48 -49.58 74.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.909 175.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 51.3 mt -74.71 -33.93 62.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.953 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 109' ' ' ALA . 15.4 ttt180 -54.35 -51.14 65.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.274 177.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.7 -36.61 80.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.873 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.3 tp -65.23 -41.01 94.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.579 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.739 ' HG ' ' HB2' ' A' ' 153' ' ' ARG . 47.2 tp -63.78 -33.65 76.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.539 177.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.3 mt -81.19 -14.98 57.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.148 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.91 -30.51 21.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.182 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.416 ' HA ' HD11 ' A' ' 8' ' ' ILE . 18.1 p -72.36 -25.92 61.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.152 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.417 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -40.67 132.62 1.75 Allowed Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.147 173.286 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.728 ' HD2' HG21 ' A' ' 11' ' ' VAL . 28.2 Cg_endo -101.15 31.27 10.14 Favored 'Cis proline' 0 N--CA 1.459 -0.528 0 C-N-CA 124.702 -0.957 . . . . 0.0 112.807 -1.007 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -60.01 141.84 54.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.902 0.382 . . . . 0.0 111.658 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.512 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 17.3 ttpt -84.62 113.89 21.59 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.98 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 41.5 mt -81.47 116.88 21.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.776 -175.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.427 HG13 ' OD1' ' A' ' 143' ' ' ASN . 89.1 t -128.88 116.72 42.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.732 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.447 ' HA ' ' O ' ' A' ' 19' ' ' PHE . 37.0 tt0 -88.13 128.39 35.43 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.496 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 8.0 t60 -97.05 77.2 2.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.488 0.661 . . . . 0.0 110.223 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.4 m -104.49 101.02 10.7 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.94 -177.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.411 ' HG3' ' HA3' ' A' ' 137' ' ' GLY . 34.9 tt0 -84.98 -43.48 13.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.556 -173.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -62.68 -52.88 61.55 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -103.68 100.56 10.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.519 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.498 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -77.74 85.52 4.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.967 0.413 . . . . 0.0 110.391 178.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.405 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 5.4 t80 -170.03 118.79 0.59 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.698 ' HB3' HD22 ' A' ' 145' ' ' LEU . 3.7 m95 71.37 10.6 6.64 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.782 0.676 . . . . 0.0 111.571 -178.276 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -136.45 -153.89 6.65 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.389 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.496 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 2.1 p-10 -91.52 -13.54 31.95 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.345 0.593 . . . . 0.0 109.846 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.498 ' HA2' ' HA ' ' A' ' 131' ' ' ALA . . . 77.06 -0.15 67.99 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.171 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.411 ' HA3' ' HG3' ' A' ' 128' ' ' GLU . . . 81.25 15.93 75.48 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.361 -0.447 . . . . 0.0 112.719 -177.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -168.1 -24.79 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -177.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 141.49 -49.65 0.76 Allowed Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.256 -0.973 . . . . 0.0 112.499 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -82.94 62.76 6.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.33 0.586 . . . . 0.0 110.126 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.18 8.62 9.03 Favored Glycine 0 C--N 1.315 -0.616 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.787 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 49.9 mttp 62.48 63.67 1.0 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 122.509 0.323 . . . . 0.0 111.228 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.427 ' OD1' HG13 ' A' ' 124' ' ' VAL . 6.4 t30 -72.66 5.16 3.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.96 0.41 . . . . 0.0 111.304 -177.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.636 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 44.7 ttm180 -47.6 -25.91 1.3 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.761 177.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.698 HD22 ' HB3' ' A' ' 133' ' ' TRP . 20.4 tp -53.9 -47.17 71.43 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.857 0.36 . . . . 0.0 110.391 175.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -62.93 -36.05 92.89 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.96 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' TYR . . . . . 0.435 ' HA ' ' HE3' ' A' ' 150' ' ' MET . 86.4 t80 -67.08 -41.3 86.57 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 176.227 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 82.1 mt -61.1 -40.23 92.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.235 -0.439 . . . . 0.0 109.93 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.459 HD21 HD22 ' A' ' 101' ' ' LEU . 96.1 mt -60.06 -46.86 88.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.53 174.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.512 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 74.2 mtm -67.5 -39.54 85.17 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.798 -178.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -70.71 -35.62 72.84 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.542 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 54.9 tp -61.95 -45.77 92.24 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 173.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.739 ' HB2' ' HG ' ' A' ' 115' ' ' LEU . 0.6 OUTLIER -52.01 -42.46 63.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.877 175.461 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -62.03 -38.24 87.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.732 -177.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -73.48 -38.72 65.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.845 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 41.0 mt -67.09 -23.28 65.83 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.084 0.468 . . . . 0.0 110.715 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.32 72.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.218 173.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.56 -33.54 64.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.699 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.25 -49.65 63.63 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.36 0.6 . . . . 0.0 110.97 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 13.7 mttp -87.06 -20.83 26.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.296 -176.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 11.5 tp -63.7 -27.9 69.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.34 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.01 6.56 0.5 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.803 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -60.79 -24.1 65.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.598 175.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -70.57 108.05 4.16 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 170.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -113.9 98.61 7.11 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.805 0.812 . . . . 0.0 112.907 -167.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -128.06 27.65 5.64 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 166.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -87.55 65.64 8.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.757 -1.11 . . . . 0.0 109.575 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 . . . . . 0 C--O 1.249 1.056 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.567 -177.364 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.426 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 23.8 mmt . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 1' ' ' MET . 5.0 Cg_exo -78.81 101.49 1.45 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.793 2.329 . . . . 0.0 111.739 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -129.58 -35.62 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.564 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 65.89 -81.13 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.957 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 61.1 90.77 0.06 Allowed 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.946 0.779 . . . . 0.0 111.919 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.494 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 12.5 mm-40 -66.77 108.97 2.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.336 0.589 . . . . 0.0 111.127 176.186 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -83.76 112.98 20.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.014 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.3 tt -76.23 -26.38 17.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.001 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 62.85 80.75 0.22 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.785 -177.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 66.67 -179.53 0.21 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.434 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.484 HG11 ' HB2' ' A' ' 121' ' ' ALA . 28.3 m -129.25 -174.41 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.631 173.337 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.2 mmt -93.71 -74.26 0.54 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.17 0.509 . . . . 0.0 110.463 -173.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -176.48 121.83 0.15 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.929 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.6 t70 54.33 39.95 31.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.792 0.806 . . . . 0.0 110.055 -176.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.4 m -76.31 140.66 41.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.139 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.434 HG12 ' HB3' ' A' ' 122' ' ' LYS . 61.2 mt -115.62 121.51 67.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.4 mt -103.88 111.0 31.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.001 -175.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.611 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 82.3 m-20 -87.88 101.34 13.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.968 173.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.511 ' CD1' ' HB2' ' A' ' 29' ' ' PHE . 42.6 p90 -101.24 128.54 47.31 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.996 0.426 . . . . 0.0 110.962 -178.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -150.57 -179.19 7.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 173.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.0 m 71.3 84.82 0.13 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.638 0.732 . . . . 0.0 110.658 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.92 -9.82 58.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.233 -175.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.5 m -99.4 3.02 45.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.737 0.304 . . . . 0.0 110.855 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -93.35 -84.83 0.29 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.339 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -171.81 -46.6 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.595 0.236 . . . . 0.0 111.072 174.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -84.18 -4.8 59.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.366 0.603 . . . . 0.0 110.605 -174.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -79.13 -0.3 82.17 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.734 -0.667 . . . . 0.0 112.274 177.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -51.28 -33.5 28.88 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -177.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.511 ' HB2' ' CD1' ' A' ' 19' ' ' PHE . 89.0 m-85 -56.98 -19.07 16.12 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -176.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.3 t -75.45 147.71 39.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.197 0.522 . . . . 0.0 110.45 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -73.27 -10.03 59.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.214 -176.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -90.15 8.35 33.36 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.408 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.35 139.22 55.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.163 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.539 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -82.67 57.35 3.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.599 -176.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.447 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 76.1 m95 -118.32 115.92 35.74 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.493 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 35' ' ' TRP . 19.4 Cg_endo -60.48 136.61 68.68 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.996 2.464 . . . . 0.0 112.386 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.561 HG22 ' HA ' ' A' ' 104' ' ' LYS . 24.4 pt -123.8 176.43 5.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.053 -178.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 42.2 tptt -131.4 100.37 5.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.3 t -119.01 130.06 74.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.936 -174.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 62.8 9.52 3.69 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 124.044 0.84 . . . . 0.0 111.362 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.94 4.02 42.11 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.82 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -120.21 146.17 46.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 117.188 0.494 . . . . 0.0 110.952 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.1 m -79.17 131.67 36.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.303 176.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.443 ' HB2' HG13 ' A' ' 37' ' ' ILE . 86.8 m95 -122.46 137.26 27.48 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 176.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.44 -36.55 98.76 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.672 2.248 . . . . 0.0 112.437 -178.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.539 HG22 ' HA ' ' A' ' 34' ' ' ALA . 81.0 p -148.18 174.16 12.26 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.3 m -72.85 -28.42 62.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.307 0.575 . . . . 0.0 109.913 174.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -68.47 -36.09 78.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.256 -179.706 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.405 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 34.4 m80 -62.37 -36.39 82.12 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.407 0.146 . . . . 0.0 111.31 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -72.57 -37.85 68.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.014 0.435 . . . . 0.0 109.952 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -62.42 -47.62 83.28 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.726 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.574 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 64.6 mm-40 -64.72 -44.88 88.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.363 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.437 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -60.41 -36.54 78.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.305 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -71.26 -29.4 65.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.573 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.606 ' HE3' HD21 ' A' ' 85' ' ' LEU . 75.3 tttt -65.37 -43.64 90.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.787 176.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.728 ' HE1' ' HG3' ' A' ' 83' ' ' LYS . 75.5 m-85 -73.64 109.85 7.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.752 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.556 HD11 ' HB3' ' A' ' 86' ' ' ARG . 11.2 mp -85.3 34.6 0.57 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.811 0.815 . . . . 0.0 108.983 168.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 56' ' ' PHE . 9.9 t0 -116.59 111.02 19.3 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.387 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -55.08 -56.14 23.2 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -171.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 60' ' ' LYS . 4.3 mptp? -72.4 -26.39 61.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.603 0.239 . . . . 0.0 111.489 -176.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.558 ' O ' HG12 ' A' ' 65' ' ' ILE . 0.4 OUTLIER -74.5 -37.93 62.99 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 178.044 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.437 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.0 ttm180 -61.76 -40.78 96.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.182 0.515 . . . . 0.0 109.958 175.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.39 -39.7 94.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.723 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -64.2 -37.87 89.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.547 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.558 HG12 ' O ' ' A' ' 61' ' ' TYR . 44.5 mm -65.42 -35.2 74.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.863 0.363 . . . . 0.0 111.042 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.04 -22.45 52.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.268 0.556 . . . . 0.0 109.562 176.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -79.11 -18.8 52.61 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.417 -176.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.9 m -93.76 131.12 41.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.345 0.593 . . . . 0.0 110.726 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.2 p -88.0 -18.88 28.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.287 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.436 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 42.0 t -80.89 124.49 81.48 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.928 -177.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 18.5 Cg_exo -68.15 -39.81 9.83 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.236 2.624 . . . . 0.0 111.992 177.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.9 tpt -65.57 -35.35 80.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.757 -176.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.655 ' O ' ' HG2' ' A' ' 77' ' ' MET . 92.8 t -66.98 -44.15 88.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.392 178.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.39 -40.03 85.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.947 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.77 -37.79 85.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.8 0.334 . . . . 0.0 110.429 175.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -64.13 -37.9 89.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.302 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.655 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 6.7 mmt -60.31 -57.13 14.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.5 0.667 . . . . 0.0 109.973 176.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.574 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -80.5 3.08 75.35 Favored Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.121 -0.945 . . . . 0.0 113.346 -174.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -80.2 -19.54 46.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 117.088 0.444 . . . . 0.0 110.1 175.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -79.08 172.56 13.64 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.894 0.378 . . . . 0.0 110.001 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -134.14 1.69 3.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.949 0.404 . . . . 0.0 110.321 -176.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.6 p -88.24 -5.16 58.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.96 0.41 . . . . 0.0 111.58 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.807 ' HE3' ' HD2' ' A' ' 84' ' ' PRO . 30.4 mmmt -89.96 151.54 45.34 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.751 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.807 ' HD2' ' HE3' ' A' ' 83' ' ' LYS . 18.9 Cg_endo -57.19 119.01 5.99 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.286 2.658 . . . . 0.0 113.182 -177.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.606 HD21 ' HE3' ' A' ' 55' ' ' LYS . 57.8 mt -107.18 169.02 8.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.186 178.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.568 ' HG2' ' HB2' ' A' ' 89' ' ' TRP . 12.7 ptm180 -100.28 175.95 5.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.822 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -60.11 -69.31 0.22 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.253 -171.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -97.38 36.38 1.48 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.792 0.33 . . . . 0.0 111.108 -176.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.599 ' CZ2' ' HB2' ' A' ' 55' ' ' LYS . 33.3 t-105 -58.66 -35.13 72.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.859 0.361 . . . . 0.0 111.75 -178.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.428 ' CD ' ' HZ3' ' A' ' 93' ' ' LYS . 63.7 mm-40 -73.5 -16.99 61.27 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.295 -177.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.9 m -99.69 -37.54 9.07 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.877 0.37 . . . . 0.0 111.282 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.404 ' O ' HG23 ' A' ' 96' ' ' VAL . 34.0 m -85.81 3.01 4.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -172.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.526 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 59.0 mttp -55.11 -46.49 75.57 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.061 0.458 . . . . 0.0 111.5 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.456 ' HG2' ' H ' ' A' ' 94' ' ' GLU . 3.9 pt-20 -68.06 -25.43 65.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.348 -177.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -75.03 -43.81 51.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.906 0.384 . . . . 0.0 110.117 176.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 92' ' ' VAL . 88.9 t -61.16 -47.33 94.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.643 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.8 mtt -65.94 -32.94 74.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.492 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.687 HH21 HD23 ' A' ' 148' ' ' LEU . 27.7 ttm180 -60.87 -43.87 97.82 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.842 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -69.51 -40.49 76.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.76 0.314 . . . . 0.0 110.543 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.1 -47.64 76.48 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.45 HD13 HD21 ' A' ' 149' ' ' LEU . 69.9 mt -66.8 -37.04 83.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.291 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.511 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 52.1 ttt180 -60.21 -48.78 80.3 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.826 177.023 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.567 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -58.52 -30.43 67.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.889 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.561 ' HA ' HG22 ' A' ' 37' ' ' ILE . 55.9 tttt -66.05 -55.0 18.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.16 177.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -74.9 -10.87 59.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.099 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.539 ' HA ' HH21 ' A' ' 112' ' ' ARG . 60.3 mt-10 -88.3 -27.79 21.48 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.885 0.374 . . . . 0.0 110.395 172.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.567 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 1.3 tp-100 -86.42 -30.82 21.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.732 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -115.24 111.75 21.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.664 0.269 . . . . 0.0 110.818 -177.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.02 -39.35 91.99 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.974 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -53.38 -47.53 69.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.081 0.467 . . . . 0.0 110.93 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.441 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 22.3 mt -74.95 -31.16 61.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.439 -176.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.539 HH21 ' HA ' ' A' ' 106' ' ' GLU . 6.7 tpp180 -56.92 -50.45 72.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.529 176.003 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.99 -38.62 76.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.895 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 60.2 tp -60.3 -45.17 94.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 35.0 tp -62.08 -44.48 96.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.086 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.531 HD21 ' HB2' ' A' ' 156' ' ' LEU . 38.6 mt -74.72 -18.17 60.54 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.66 0.267 . . . . 0.0 111.21 -177.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.95 -23.22 52.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.446 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 57.9 p -71.88 -24.64 61.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.883 0.373 . . . . 0.0 110.931 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.474 ' HB2' ' HE ' ' A' ' 153' ' ' ARG . . . -47.84 136.47 10.62 Favored Pre-proline 0 C--O 1.234 0.25 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.891 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.432 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 27.6 Cg_endo -100.78 33.3 8.6 Favored 'Cis proline' 0 CA--C 1.534 0.511 0 C-N-CA 124.26 -1.142 . . . . 0.0 113.641 -1.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.484 ' HB2' HG11 ' A' ' 11' ' ' VAL . . . -67.53 159.06 30.5 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -175.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.434 ' HB3' HG12 ' A' ' 16' ' ' ILE . 44.3 tttp -88.27 121.33 30.54 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.759 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.0 mt -90.09 114.34 26.24 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.787 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.611 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 61.6 t -129.61 114.96 32.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.625 -0.262 . . . . 0.0 111.118 -178.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -74.18 118.53 17.24 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.513 ' HA ' ' HB2' ' A' ' 135' ' ' ASP . 80.8 t60 -85.53 77.51 9.85 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.865 -0.734 . . . . 0.0 109.188 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.51 107.31 9.87 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.633 178.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -106.61 15.93 25.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.553 0.692 . . . . 0.0 110.404 -175.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -125.98 -25.04 3.65 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.371 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -131.86 136.78 47.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.49 176.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.53 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -99.9 85.81 3.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.34 0.591 . . . . 0.0 109.843 173.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 5.6 t80 178.07 140.32 0.09 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.006 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.752 ' HB3' HD22 ' A' ' 145' ' ' LEU . 12.2 m95 74.93 6.29 4.33 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.872 0.732 . . . . 0.0 112.089 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -172.3 -113.85 0.31 Allowed Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 118.572 -1.775 . . . . 0.0 114.369 -178.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.513 ' HB2' ' HA ' ' A' ' 126' ' ' HIS . 9.8 t70 -98.57 -49.42 4.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.068 -0.566 . . . . 0.0 112.007 -167.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.53 ' HA2' ' HA ' ' A' ' 131' ' ' ALA . . . 82.6 -6.22 70.41 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.981 -177.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 94.2 16.95 41.86 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.586 -0.606 . . . . 0.0 111.586 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 20.4 p80 -168.6 24.91 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.501 -0.35 . . . . 0.0 111.005 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 79.08 -46.29 2.93 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.389 -0.434 . . . . 0.0 113.891 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -88.25 68.18 8.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.126 0.965 . . . . 0.0 110.67 -173.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -122.87 15.42 8.38 Favored Glycine 0 C--N 1.311 -0.82 0 CA-C-N 114.002 -1.454 . . . . 0.0 111.86 177.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 45.9 mttt 72.55 80.87 0.14 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.492 0.663 . . . . 0.0 111.36 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.406 HD21 ' HA ' ' A' ' 124' ' ' VAL . 4.9 t-20 -67.49 4.79 0.93 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.741 -1.118 . . . . 0.0 111.774 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.724 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 12.3 ttp180 -58.22 -22.1 50.61 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.866 -0.521 . . . . 0.0 112.239 -175.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.752 HD22 ' HB3' ' A' ' 133' ' ' TRP . 41.8 tp -66.08 -48.47 70.86 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 174.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -64.46 -28.9 73.77 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 174.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -68.83 -37.31 79.08 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 79.7 mt -58.85 -47.61 84.27 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 172.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.45 HD21 HD13 ' A' ' 101' ' ' LEU . 96.0 mt -61.77 -38.5 88.23 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.866 178.009 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.408 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 72.4 mtm -72.11 -40.16 68.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.656 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -67.19 -38.66 85.75 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.121 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.541 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 61.3 tp -62.32 -46.21 89.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.687 174.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.474 ' HE ' ' HB2' ' A' ' 119' ' ' ALA . 2.8 ttp-105 -52.23 -44.99 65.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.644 175.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -67.44 -38.83 85.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.6 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -72.61 -35.62 67.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.903 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 76.5 mt -74.78 -23.54 58.53 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 176.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.404 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -72.4 -25.16 61.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.441 175.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.73 -39.75 82.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 175.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -63.34 -38.54 91.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.341 174.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -63.88 -41.1 97.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.23 176.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' LEU . . . . . 0.404 HD13 ' O ' ' A' ' 157' ' ' ALA . 8.3 mp -67.4 -46.26 73.78 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.423 178.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -84.53 11.31 8.96 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 164' ' ' HIS . 0.7 OUTLIER -66.66 139.37 57.85 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.582 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 164' ' ' HIS . . . . . 0.417 ' HB2' ' O ' ' A' ' 163' ' ' HIS . 32.2 t-80 164.99 -41.42 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -170.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -139.55 31.14 2.09 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.636 176.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.437 ' O ' ' HB2' ' A' ' 167' ' ' HIS . 1.7 m-70 -111.07 75.22 0.91 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 167' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 166' ' ' HIS . 74.5 m80 73.44 -43.7 0.56 Allowed 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.978 0.799 . . . . 0.0 109.137 -167.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 . . . . . 0 C--O 1.249 1.061 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 168.715 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.5 mtm . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -78.24 -167.5 0.5 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 122.647 2.231 . . . . 0.0 112.215 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 37.6 t -84.83 85.82 2.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.297 0.57 . . . . 0.0 110.312 -179.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -107.42 29.8 6.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.314 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.85 76.75 1.15 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.142 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -151.53 118.17 5.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.577 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -165.34 -33.83 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.545 175.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 65.8 mt -87.69 108.37 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.601 176.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -62.1 -61.81 2.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.652 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -172.59 127.04 0.51 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.971 -1.013 . . . . 0.0 108.556 176.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.4 m -70.99 151.38 9.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.966 0.413 . . . . 0.0 110.556 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.481 ' HG2' ' OG1' ' A' ' 15' ' ' THR . 0.0 OUTLIER -75.35 -66.66 0.74 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.234 -178.617 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' MET . 58.3 tt0 174.51 -39.11 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.164 -0.925 . . . . 0.0 109.047 176.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -82.78 12.28 4.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.431 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.501 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 18.0 m -82.44 138.75 34.31 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.576 -174.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.635 HG12 ' HE3' ' A' ' 122' ' ' LYS . 61.2 mt -124.81 120.81 59.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.201 174.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.2 mp -89.98 101.22 12.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.628 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 18.7 m120 -91.77 101.06 13.66 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 176.311 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.428 ' HB2' ' CB ' ' A' ' 26' ' ' TYR . 37.1 p90 -107.38 174.82 5.72 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.344 -174.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.57 -179.26 5.58 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.266 -177.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.481 ' HA ' ' OG ' ' A' ' 30' ' ' SER . 17.2 m -64.51 -173.51 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.84 0.713 . . . . 0.0 112.356 -176.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.718 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 34.2 p -67.34 2.69 1.55 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -169.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.4 t -92.93 12.06 25.15 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.372 0.606 . . . . 0.0 109.801 176.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -129.22 166.63 19.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.172 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -61.55 -35.29 77.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.893 0.378 . . . . 0.0 110.668 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.428 ' CB ' ' HB2' ' A' ' 19' ' ' PHE . 98.8 m-85 -80.76 -1.42 42.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.954 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.718 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -57.03 -23.0 44.69 Favored Glycine 0 CA--C 1.52 0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 114.408 -174.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -69.44 -14.19 62.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 117.524 0.662 . . . . 0.0 111.27 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -73.44 -38.92 65.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.801 -0.181 . . . . 0.0 110.851 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.481 ' OG ' ' HA ' ' A' ' 21' ' ' SER . 64.6 m -59.27 158.84 8.51 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.674 0.749 . . . . 0.0 112.964 -173.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -69.96 -19.82 63.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.549 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.624 ' CE1' ' HB2' ' A' ' 71' ' ' PRO . 13.0 t80 -92.54 7.24 44.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.542 -176.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.417 ' HB1' ' HD1' ' A' ' 35' ' ' TRP . . . -72.52 129.0 37.3 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.593 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.521 ' HA ' HG23 ' A' ' 46' ' ' THR . . . -80.17 60.39 3.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.255 0.55 . . . . 0.0 111.387 -175.007 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.417 ' HD1' ' HB1' ' A' ' 33' ' ' ALA . 58.5 m95 -111.16 112.43 55.15 Favored Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.388 174.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.446 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 42.2 Cg_exo -57.13 126.91 23.65 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 123.183 2.589 . . . . 0.0 113.237 -175.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.504 ' CG1' ' HB2' ' A' ' 44' ' ' TRP . 37.6 pt -103.33 145.2 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.49 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.514 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 14.9 tptm -108.39 92.59 4.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.957 0.408 . . . . 0.0 109.901 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 26.1 t -121.33 128.25 75.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.136 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.7 t70 66.8 16.91 10.49 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.811 0.815 . . . . 0.0 110.255 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.9 10.97 83.34 Favored Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.703 -176.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 57.6 mttp -111.01 143.26 41.98 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 56.8 m -94.48 113.28 25.1 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.534 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.504 ' HB2' ' CG1' ' A' ' 37' ' ' ILE . 62.4 m95 -104.31 126.0 32.72 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 176.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 23.3 Cg_exo -62.91 -13.63 36.01 Favored 'Trans proline' 0 N--CA 1.473 0.281 0 C-N-CA 123.177 2.585 . . . . 0.0 113.059 -175.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.521 HG23 ' HA ' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -164.91 151.8 10.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.069 -178.256 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.9 m -58.53 -34.1 70.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.102 0.477 . . . . 0.0 109.954 175.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 51' ' ' PHE . 15.9 tm-20 -54.1 -42.97 69.98 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.311 177.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -69.54 -37.19 76.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.6 -175.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.468 ' CE2' HG13 ' A' ' 96' ' ' VAL . 90.8 t80 -69.91 -35.95 75.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 176.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.476 ' CZ ' ' HZ2' ' A' ' 89' ' ' TRP . 68.6 t80 -56.29 -52.51 64.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.761 177.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.638 ' NE2' ' HA ' ' A' ' 75' ' ' ALA . 17.1 mm-40 -66.81 -50.11 63.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.134 -178.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.51 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -58.51 -30.47 67.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.353 -177.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.456 ' HG2' HG22 ' A' ' 96' ' ' VAL . 6.1 tp60 -78.4 -42.92 28.82 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.154 178.216 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.549 ' HG2' HD22 ' A' ' 85' ' ' LEU . 27.3 ttpp -57.06 -39.65 75.32 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.158 -177.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -92.46 139.77 30.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.401 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.825 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.5 pt? -113.45 18.4 17.73 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.371 0.605 . . . . 0.0 110.275 -178.186 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -96.11 128.25 42.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.631 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -60.75 -48.01 83.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.463 -177.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -59.12 -46.38 88.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.701 0.286 . . . . 0.0 111.498 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.522 ' CZ ' ' HE3' ' A' ' 83' ' ' LYS . 2.5 t80 -74.39 -32.59 62.78 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.01 -174.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.51 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 41.7 ttm180 -64.88 -35.32 80.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.226 0.536 . . . . 0.0 109.618 174.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.537 ' HG2' ' HD3' ' A' ' 67' ' ' ARG . 31.1 tt0 -70.24 -31.39 68.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.247 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -59.8 -48.85 80.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.042 0.449 . . . . 0.0 110.154 173.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.436 HG21 ' HB2' ' A' ' 52' ' ' GLN . 37.8 mm -62.14 -37.98 79.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.005 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -71.38 -23.81 61.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.019 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.537 ' HD3' ' HG2' ' A' ' 63' ' ' GLU . 25.5 mtp180 -99.78 13.68 32.87 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -173.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.7 m -118.69 132.41 68.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.073 0.463 . . . . 0.0 110.35 174.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.9 m -84.91 -30.72 24.14 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.084 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.431 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 39.6 m -81.19 122.2 81.2 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.036 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.624 ' HB2' ' CE1' ' A' ' 32' ' ' PHE . 10.8 Cg_exo -70.97 -33.31 12.2 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 123.073 2.515 . . . . 0.0 111.795 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.451 ' O ' ' HG3' ' A' ' 76' ' ' ARG . 52.3 ttm -60.82 -39.51 89.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.803 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.516 ' O ' ' HG3' ' A' ' 77' ' ' MET . 84.1 t -61.15 -52.0 66.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.327 177.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.7 98.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.025 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.638 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -60.32 -50.33 74.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.596 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 72' ' ' MET . 77.1 mtp180 -64.77 -47.78 76.93 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -175.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.516 ' HG3' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -85.01 -8.29 58.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.979 0.419 . . . . 0.0 111.391 -177.696 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -93.87 -17.09 42.36 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.916 176.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -89.87 -1.15 57.92 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -175.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -82.37 131.23 35.23 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.018 174.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -106.13 22.68 15.29 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.626 0.727 . . . . 0.0 110.459 -170.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 59.8 m -70.87 -36.8 72.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.729 173.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.522 ' HE3' ' CZ ' ' A' ' 61' ' ' TYR . 16.1 pttm -86.53 158.12 54.74 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.797 175.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.438 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 60.7 Cg_endo -71.71 154.71 59.28 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.616 2.211 . . . . 0.0 113.473 -174.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.549 HD22 ' HG2' ' A' ' 55' ' ' LYS . 52.9 mt -121.57 171.95 8.45 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 175.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -70.79 141.18 51.4 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.7 -0.8 . . . . 0.0 109.37 174.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.471 ' HE3' ' HB2' ' A' ' 87' ' ' LYS . 35.1 ttmt -61.24 -46.66 89.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.168 -169.253 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -86.75 24.29 1.5 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.485 ' HA ' HG22 ' A' ' 92' ' ' VAL . 65.7 t-105 -59.06 -36.03 74.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.737 0.304 . . . . 0.0 111.56 -177.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.89 -30.46 67.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.839 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 28.8 m -94.8 -40.58 9.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.849 0.356 . . . . 0.0 111.075 -177.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.5 m -79.06 -8.08 11.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -176.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 97' ' ' MET . 62.3 tttp -52.83 -46.5 67.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.653 0.264 . . . . 0.0 111.155 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -77.63 -28.83 51.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.696 0.284 . . . . 0.0 111.061 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -68.88 -42.25 77.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.088 0.471 . . . . 0.0 109.988 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.468 HG13 ' CE2' ' A' ' 50' ' ' TYR . 75.4 t -61.35 -46.76 95.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.396 176.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.456 ' HG2' ' O ' ' A' ' 93' ' ' LYS . 83.2 mmm -61.04 -40.07 92.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.809 178.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 25.7 ttm-85 -62.26 -43.64 98.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.544 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -61.9 -44.46 96.75 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.884 0.373 . . . . 0.0 110.589 178.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.92 -44.21 93.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.121 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -69.53 -41.22 76.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.014 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -58.34 -53.67 55.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.539 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.97 -26.56 68.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.949 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -65.06 -55.31 19.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.64 178.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -79.3 -6.39 56.61 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.947 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.778 ' HA ' HH21 ' A' ' 112' ' ' ARG . 20.9 mt-10 -92.08 -35.45 13.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.598 0.237 . . . . 0.0 110.999 173.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.514 ' NE2' ' HB2' ' A' ' 38' ' ' LYS . 0.8 OUTLIER -66.41 -45.1 81.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.027 0.442 . . . . 0.0 110.364 179.23 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -113.81 111.41 21.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.114 -176.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.36 -22.14 66.25 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.61 178.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -57.12 -49.02 77.21 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.362 0.601 . . . . 0.0 109.873 175.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.8 mt -69.32 -38.39 78.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.231 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.778 HH21 ' HA ' ' A' ' 106' ' ' GLU . 42.5 ttm180 -58.42 -43.7 88.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.508 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.94 -43.03 99.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.836 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.7 tp -65.97 -40.15 91.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.537 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.665 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 44.0 tp -65.62 -35.39 80.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.985 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.1 mp -88.55 -3.77 58.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.881 0.372 . . . . 0.0 111.077 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.12 -34.73 24.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.048 0.452 . . . . 0.0 109.792 172.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 20.9 p -75.23 -14.96 60.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.936 176.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.414 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -59.3 138.23 88.65 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.275 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 67.7 Cg_endo -104.99 39.66 3.47 Favored 'Cis proline' 0 N--CA 1.458 -0.6 0 C-N-CA 124.819 -0.909 . . . . 0.0 113.2 -2.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.501 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -75.48 176.28 7.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.94 0.4 . . . . 0.0 111.821 -176.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.635 ' HE3' HG12 ' A' ' 16' ' ' ILE . 51.6 mtmt -92.92 130.78 38.39 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.187 -179.44 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 59.8 mt -94.07 113.62 25.62 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.993 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.628 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 86.1 t -132.82 107.07 11.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.494 -175.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -77.34 117.82 19.2 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.439 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 7.4 t60 -85.71 113.32 21.81 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 3.6 t -136.95 112.49 9.34 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.382 0.611 . . . . 0.0 109.896 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.0 18.73 17.74 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.043 0.925 . . . . 0.0 108.548 171.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -95.53 -44.46 7.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.125 177.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -130.02 166.74 19.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.148 176.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.64 86.34 2.23 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.405 175.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -160.11 -35.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.124 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.671 ' HB3' HD22 ' A' ' 145' ' ' LEU . 71.5 m95 -120.79 20.71 11.63 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.485 -179.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -150.73 -150.31 5.26 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.43 -175.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.439 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 1.3 p-10 -82.43 -14.93 54.32 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 122.291 -0.534 . . . . 0.0 110.334 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.569 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 68.0 26.42 73.99 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.886 176.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 76.81 -27.26 1.64 Allowed Glycine 0 CA--C 1.52 0.375 0 N-CA-C 114.31 0.484 . . . . 0.0 114.31 176.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' HIS . . . . . 0.468 ' NE2' ' HB3' ' A' ' 140' ' ' LYS . 20.7 p-80 -132.65 11.78 4.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.518 0.659 . . . . 0.0 111.801 -172.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 99.32 -27.09 21.72 Favored Glycine 0 CA--C 1.517 0.166 0 C-N-CA 120.552 -0.832 . . . . 0.0 113.048 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.468 ' HB3' ' NE2' ' A' ' 138' ' ' HIS . 65.6 tttp -107.4 69.97 0.77 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.587 0.708 . . . . 0.0 110.025 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.569 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -124.19 15.23 7.78 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.257 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 61.2 mttt 61.97 77.05 0.34 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.773 0.797 . . . . 0.0 110.929 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.424 ' OD1' HG13 ' A' ' 124' ' ' VAL . 8.8 t30 -77.9 5.58 9.39 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.75 -176.052 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.493 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 69.0 mtp85 -47.37 -22.22 0.4 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -178.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.671 HD22 ' HB3' ' A' ' 133' ' ' TRP . 49.2 tp -56.59 -47.54 79.37 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.272 0.558 . . . . 0.0 110.237 173.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.613 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -67.42 -27.96 73.59 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.792 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -68.93 -37.87 79.17 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 79.6 mt -61.26 -41.87 97.67 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.6 -34.33 78.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.837 177.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.613 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 67.4 mtt -61.48 -49.24 77.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.73 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -67.38 -37.15 82.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.71 0.29 . . . . 0.0 110.805 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 68.1 tp -63.67 -42.77 98.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.032 0.444 . . . . 0.0 110.065 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.665 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 1.1 ttp-105 -61.7 -42.55 99.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.954 177.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -57.52 -43.97 84.72 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.219 177.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -66.65 -45.5 78.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.255 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.503 HD12 HD23 ' A' ' 115' ' ' LEU . 90.9 mt -69.41 -28.16 65.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.828 0.347 . . . . 0.0 110.627 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -60.8 -45.46 94.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.186 175.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 69.8 mt -69.14 -34.07 61.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.72 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -56.39 -52.8 63.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.045 0.45 . . . . 0.0 109.79 177.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -76.44 -25.2 54.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.769 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 13.7 tp -70.11 -32.56 70.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.195 0.521 . . . . 0.0 110.005 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.13 -58.68 3.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.189 177.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 33.6 p80 42.7 28.7 0.13 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.495 1.118 . . . . 0.0 113.671 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -101.06 -34.29 9.79 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -68.4 132.37 46.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.155 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 50.7 m80 -104.36 -172.63 2.14 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.433 -178.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -89.08 130.76 35.48 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 177.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 30.5 m170 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.641 -0.695 . . . . 0.0 109.975 -175.495 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.408 ' O ' ' HG3' ' A' ' 1' ' ' MET . 24.0 ptm . . . . . 0 N--CA 1.48 1.067 0 CA-C-O 121.051 0.453 . . . . 0.0 110.436 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -85.98 155.77 9.94 Favored 'Trans proline' 0 N--CA 1.453 -0.859 0 C-N-CA 122.441 2.094 . . . . 0.0 111.706 177.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -69.5 125.7 28.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 176.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -82.68 84.79 7.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.667 0.746 . . . . 0.0 109.941 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.95 44.75 1.15 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.682 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -77.81 91.68 4.14 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 173.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.405 ' HG2' HD12 ' A' ' 114' ' ' LEU . 32.0 mtt85 -77.79 162.66 26.75 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.484 -1.235 . . . . 0.0 111.511 -169.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 54.1 mt -65.47 127.29 26.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.956 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.501 ' O ' ' HB2' ' A' ' 10' ' ' HIS . 21.6 mm-40 -77.53 65.64 3.09 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.138 -179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.501 ' HB2' ' O ' ' A' ' 9' ' ' GLN . 17.8 m80 74.23 123.64 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.954 -174.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.421 HG21 ' HB2' ' A' ' 121' ' ' ALA . 32.3 m -83.73 179.91 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.909 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 29.0 mtm -91.92 164.33 13.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.02 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -58.08 116.75 3.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.338 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 52.01 74.16 0.28 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.523 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.43 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 31.5 m -96.8 121.72 38.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.858 177.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 35.3 mm -81.33 95.78 2.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 176.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.9 mt -90.07 91.61 3.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.443 0.639 . . . . 0.0 109.794 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.62 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.3 p30 -96.49 101.96 13.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.421 178.504 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -102.81 132.08 49.24 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.519 -172.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -150.2 100.47 2.9 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.566 173.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.515 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 18.4 t 176.29 61.7 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -177.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.2 m -74.53 2.72 9.01 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.32 -171.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.36 -79.0 0.02 OUTLIER 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -175.37 81.65 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -170.55 -110.43 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.883 -172.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -101.26 -15.69 17.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.2 0.524 . . . . 0.0 110.243 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.515 ' HA3' ' O ' ' A' ' 21' ' ' SER . . . -74.08 -0.45 56.45 Favored Glycine 0 CA--C 1.52 0.364 0 CA-C-N 115.863 -0.608 . . . . 0.0 113.303 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.36 -1.56 3.57 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.023 0.44 . . . . 0.0 112.004 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.409 ' O ' ' HE2' ' A' ' 104' ' ' LYS . 15.3 m-85 -65.17 -32.31 73.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.578 169.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.9 m -62.99 156.71 23.82 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.437 0.637 . . . . 0.0 112.046 -174.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.624 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 5.5 p-10 -70.66 -24.93 62.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.906 178.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -76.6 -2.26 31.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.715 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.442 ' O ' HG22 ' A' ' 46' ' ' THR . . . -64.72 136.1 56.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.945 -177.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.79 57.83 2.66 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.456 -172.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 66.2 m95 -116.63 105.5 49.88 Favored Pre-proline 0 C--N 1.316 -0.86 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.607 177.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.27 138.18 78.86 Favored 'Trans proline' 0 C--O 1.238 0.482 0 C-N-CA 123.324 2.683 . . . . 0.0 113.029 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.403 HG13 ' HB2' ' A' ' 44' ' ' TRP . 16.2 pt -123.81 137.65 56.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.363 -178.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.413 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 46.1 tptt -98.66 107.67 20.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.423 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.0 t -123.72 113.27 36.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -174.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 55.27 36.72 27.65 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.437 172.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.08 -1.18 62.74 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.502 173.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HE3' ' CZ2' ' A' ' 44' ' ' TRP . 54.4 mtmt -129.34 144.7 51.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 117.635 0.718 . . . . 0.0 110.42 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.0 m -98.53 122.74 42.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.861 -175.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.478 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 41.5 m95 -112.16 134.55 21.44 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.642 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 37.9 Cg_exo -60.79 -41.63 44.56 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.833 2.355 . . . . 0.0 112.554 -177.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.442 HG22 ' O ' ' A' ' 33' ' ' ALA . 21.0 p -144.77 178.63 7.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.698 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.624 ' HB2' ' HB2' ' A' ' 31' ' ' ASN . 21.5 m -74.02 -44.1 55.62 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -173.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.494 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 1.9 pm0 -76.93 -10.31 59.28 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.502 -173.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.538 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 11.2 m80 -71.74 -38.01 70.49 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 172.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -71.46 -35.81 70.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.494 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 83.0 t80 -59.89 -56.42 21.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.549 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.521 ' NE2' ' HA3' ' A' ' 78' ' ' GLY . 5.1 mm100 -66.28 -21.7 66.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.211 -0.45 . . . . 0.0 112.016 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.457 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -76.32 -48.99 18.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.004 0.43 . . . . 0.0 110.455 176.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -69.47 -14.48 62.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.136 0.493 . . . . 0.0 110.338 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -60.64 -34.45 74.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.769 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.514 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 96.8 m-85 -109.17 157.7 18.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.383 -178.188 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.461 HD12 ' H ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -112.14 32.7 5.33 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.265 0.555 . . . . 0.0 111.1 -177.883 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.504 ' OD2' ' HB2' ' A' ' 60' ' ' LYS . 8.6 t70 -136.0 118.34 15.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.518 178.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.58 ' HA ' ' HB2' ' A' ' 62' ' ' ARG . 21.4 mm-40 -65.97 -14.07 60.93 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -177.012 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.504 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . 58.4 mttp -72.71 -55.11 7.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.96 0.409 . . . . 0.0 109.956 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.42 ' O ' HG12 ' A' ' 65' ' ' ILE . 55.2 t80 -71.6 -26.0 62.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.933 0.397 . . . . 0.0 110.321 177.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.58 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . 12.5 mtp180 -71.44 -27.34 63.21 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.805 0.336 . . . . 0.0 110.507 175.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.3 tt0 -69.91 -32.38 70.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 170.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.02 -40.75 95.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.591 175.122 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.42 HG12 ' O ' ' A' ' 61' ' ' TYR . 40.5 mm -65.16 -29.79 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.693 0.758 . . . . 0.0 110.29 175.267 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -74.58 -29.54 61.37 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.267 174.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -81.01 -28.47 35.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.207 -177.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.458 ' O ' HG13 ' A' ' 68' ' ' VAL . 10.3 p -70.83 101.37 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.722 0.772 . . . . 0.0 110.139 177.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.9 m -76.05 -26.17 56.32 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.966 -177.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.479 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.1 m -78.97 133.47 61.46 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.395 178.253 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.538 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 28.0 Cg_exo -62.12 -65.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.359 2.706 . . . . 0.0 113.986 -175.004 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 27.8 ttt -68.95 -26.45 65.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.776 0.322 . . . . 0.0 111.5 -172.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 86.3 t -62.82 -28.88 45.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.041 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.77 -47.49 84.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.031 0.443 . . . . 0.0 110.707 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.99 -30.52 62.52 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.95 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.42 ' HE ' ' C ' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -63.11 -49.12 75.65 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.574 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -77.54 -24.67 49.87 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 176.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.521 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -76.78 -2.14 75.17 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.274 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 76' ' ' ARG . 21.3 mmt180 -67.18 -18.77 65.41 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 122.31 0.244 . . . . 0.0 110.883 170.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.523 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 20.5 t70 -69.07 134.12 48.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.024 0.44 . . . . 0.0 110.402 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 81' ' ' ARG . 24.6 ttp-105 -118.18 17.87 13.89 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.278 -175.282 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 88.2 p -98.13 0.39 45.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.503 0.668 . . . . 0.0 109.593 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.523 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 41.1 mmtm -95.75 153.26 39.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 174.044 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.69 103.85 1.71 Allowed 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 121.44 1.426 . . . . 0.0 112.075 -178.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.416 HD21 ' HG3' ' A' ' 81' ' ' ARG . 2.4 pp -109.68 169.85 8.44 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.165 176.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 -86.07 133.23 33.9 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.04 -176.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -70.6 -33.39 71.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.842 0.353 . . . . 0.0 111.0 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -85.4 9.98 14.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.096 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.468 ' HA ' HG22 ' A' ' 92' ' ' VAL . 67.8 t-105 -54.5 -30.44 53.43 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.969 0.414 . . . . 0.0 110.203 175.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -53.66 -32.23 50.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.618 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.2 m -99.82 -45.46 5.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.698 0.285 . . . . 0.0 111.498 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.468 HG22 ' HA ' ' A' ' 89' ' ' TRP . 31.9 m -74.94 -11.22 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -171.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.4 pttm -63.27 -29.59 70.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.771 0.32 . . . . 0.0 110.647 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.495 ' OE1' ' HD3' ' A' ' 144' ' ' ARG . 9.5 mm-40 -68.16 -39.89 82.47 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.644 0.735 . . . . 0.0 109.49 177.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -71.87 -41.66 67.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.882 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.416 HG21 ' CZ3' ' A' ' 89' ' ' TRP . 79.7 t -63.8 -39.55 85.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.065 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.8 mmt -62.49 -46.14 89.81 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.576 176.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.719 HH21 HD23 ' A' ' 148' ' ' LEU . 26.1 ttm180 -63.75 -32.57 74.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.35 . . . . 0.0 110.545 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -63.93 -50.33 69.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.365 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.36 87.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.976 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.6 -35.52 80.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.098 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -58.88 -53.83 53.97 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.95 -37.51 82.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.739 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.409 ' HE2' ' O ' ' A' ' 29' ' ' PHE . 59.0 tttp -52.61 -54.02 38.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.357 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -86.5 -8.38 57.62 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.714 ' HA ' HH21 ' A' ' 112' ' ' ARG . 24.9 mt-10 -92.61 -33.01 14.58 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 121.868 -0.52 . . . . 0.0 111.518 175.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.413 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 78.5 mm-40 -79.17 -30.87 43.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.674 0.273 . . . . 0.0 110.761 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -115.28 103.38 10.76 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.778 0.323 . . . . 0.0 110.997 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.474 ' HA ' ' HB3' ' A' ' 112' ' ' ARG . . . -65.26 -24.42 67.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.513 178.689 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.517 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 2.0 mp0 -51.4 -56.08 15.13 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.455 172.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.9 mt -74.2 -31.65 62.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.333 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.714 HH21 ' HA ' ' A' ' 106' ' ' GLU . 13.7 tpp85 -50.48 -60.62 2.82 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.316 177.428 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.16 -34.35 70.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.025 -176.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.405 HD12 ' HG2' ' A' ' 7' ' ' ARG . 47.3 tp -61.91 -40.22 94.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.434 178.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 29.3 tp -67.64 -49.56 62.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.278 178.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.541 HD21 ' HB2' ' A' ' 156' ' ' LEU . 53.0 mt -63.56 -24.89 68.0 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -173.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -74.47 -7.22 52.28 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 72.0 p -86.8 -15.4 39.38 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.363 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.432 ' HA ' HH21 ' A' ' 153' ' ' ARG . . . -54.87 141.86 56.74 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.394 177.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.583 ' HA ' HH21 ' A' ' 153' ' ' ARG . 43.9 Cg_endo -101.22 41.94 3.45 Favored 'Cis proline' 0 CA--C 1.535 0.572 0 C-N-CA 124.5 -1.042 . . . . 0.0 113.134 -1.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.43 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -72.92 166.93 22.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.94 0.4 . . . . 0.0 111.704 -178.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.427 ' HE3' ' ND2' ' A' ' 143' ' ' ASN . 39.3 tttp -100.98 119.35 38.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.589 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 24.2 mt -88.7 125.35 34.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.433 -175.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.62 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 42.2 t -134.36 134.11 54.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.432 -175.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.517 ' HB3' ' HA3' ' A' ' 134' ' ' GLY . 0.0 OUTLIER -81.02 137.66 36.04 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.31 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 18' ' ' ASN . 23.7 t-160 -130.77 79.94 1.92 Allowed 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.55 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.5 t -87.55 166.22 14.9 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 164.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -140.16 67.75 1.37 Allowed 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.833 0.825 . . . . 0.0 110.454 -176.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -162.69 -44.85 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.866 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.507 ' O ' ' HA2' ' A' ' 136' ' ' GLY . 2.6 m-20 -125.9 -179.9 4.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -124.17 86.19 2.53 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 170.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -97.35 -49.55 4.88 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -167.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.629 ' HB3' ' HB2' ' A' ' 145' ' ' LEU . 78.9 m95 -140.06 25.18 2.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.457 0.646 . . . . 0.0 110.588 178.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.517 ' HA3' ' HB3' ' A' ' 125' ' ' GLU . . . -163.07 -84.22 0.05 OUTLIER Glycine 0 N--CA 1.439 -1.163 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.575 -177.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -160.1 164.28 33.17 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.502 -178.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.507 ' HA2' ' O ' ' A' ' 130' ' ' ASP . . . -98.38 24.12 33.32 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 175.416 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 74.24 37.27 48.76 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 115.071 -0.565 . . . . 0.0 113.748 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 -144.58 -27.0 0.5 Allowed 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' A' ' 140' ' ' LYS . . . 99.71 56.44 0.96 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.282 -0.485 . . . . 0.0 113.218 174.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 139' ' ' GLY . 13.0 ttpp 169.86 69.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 123.675 0.79 . . . . 0.0 109.126 176.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -132.35 -65.11 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 119.333 -1.413 . . . . 0.0 114.363 -175.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 39.6 tttm -178.51 52.08 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.499 0.65 . . . . 0.0 111.088 -171.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.509 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 49.6 t30 -69.28 5.29 1.32 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.076 0.95 . . . . 0.0 111.708 -177.102 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.702 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 1.6 ttt180 -57.58 -21.43 38.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.629 ' HB2' ' HB3' ' A' ' 133' ' ' TRP . 23.6 tp -65.53 -44.45 86.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.357 175.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -66.35 -32.14 81.06 Favored Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.177 175.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -61.85 -40.57 95.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.017 0.437 . . . . 0.0 110.032 175.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.719 HD23 HH21 ' A' ' 98' ' ' ARG . 46.4 mt -63.73 -45.5 89.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.767 174.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.4 mt -61.02 -46.24 91.53 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.33 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 58.1 mtm -64.84 -43.4 93.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.907 -176.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 155' ' ' GLN . 33.4 mt-10 -63.73 -44.97 91.96 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.64 176.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 58.7 tp -58.82 -45.21 90.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.182 0.515 . . . . 0.0 110.161 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.849 HH11 ' HB3' ' A' ' 153' ' ' ARG . 1.2 ttp-105 -57.82 -43.48 85.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.873 177.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.7 -40.79 97.66 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.802 177.357 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 151' ' ' GLU . 19.7 mm-40 -65.87 -41.45 91.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.749 179.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.541 ' HB2' HD21 ' A' ' 116' ' ' LEU . 97.2 mt -66.13 -36.36 82.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.859 0.361 . . . . 0.0 110.267 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -63.72 -42.48 97.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.858 177.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 77.5 mt -70.22 -43.79 78.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.704 0.288 . . . . 0.0 111.046 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -62.71 -29.12 70.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.293 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -87.28 -29.66 21.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.433 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 15.9 tp -62.05 -35.49 78.79 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.879 -177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -79.68 11.72 3.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.782 -0.644 . . . . 0.0 112.175 -176.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -75.86 -8.37 56.72 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 122.284 -0.26 . . . . 0.0 111.344 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -68.37 -76.69 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.683 0.278 . . . . 0.0 110.867 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 22.1 t-80 -121.08 106.34 11.46 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 42.4 t60 -171.14 127.07 0.69 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.511 -170.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -91.42 -71.1 0.65 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.411 177.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.261 -0.876 . . . . 0.0 109.575 177.521 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.4 mtt . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 120.66 0.266 . . . . 0.0 110.574 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -69.18 93.45 0.47 Allowed 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.621 2.214 . . . . 0.0 111.878 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.479 ' O ' ' HB2' ' A' ' 25' ' ' ASP . 12.5 p -79.67 -22.96 12.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.355 -177.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 4' ' ' ARG . 14.7 mtp180 66.27 -79.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.303 -175.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.557 ' HB1' HD22 ' A' ' 114' ' ' LEU . . . 73.01 -40.29 0.47 Allowed 'General case' 0 N--CA 1.469 0.497 0 O-C-N 124.004 0.815 . . . . 0.0 112.062 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -68.46 100.98 1.16 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.905 0.383 . . . . 0.0 111.773 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -109.85 -42.14 4.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 168.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 38.3 pt -107.01 159.85 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.217 171.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -144.23 108.69 4.84 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.2 t60 67.69 107.27 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.891 0.745 . . . . 0.0 110.935 -178.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -83.91 168.0 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.269 177.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.497 ' HG2' ' H ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -80.73 -84.55 0.1 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.965 -179.156 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.497 ' H ' ' HG2' ' A' ' 12' ' ' MET . 81.9 mm-40 -133.61 -72.17 0.5 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -175.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -137.16 86.8 2.23 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.712 -171.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.3 t -117.94 149.93 40.08 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.34 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.518 HD13 ' HB2' ' A' ' 122' ' ' LYS . 32.1 mm -94.68 113.18 28.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.924 177.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.0 mt -96.05 101.89 12.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 120.924 0.392 . . . . 0.0 110.301 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.428 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 22.9 m-80 -84.86 104.21 14.61 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.014 177.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -109.92 130.61 55.51 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.92 0.391 . . . . 0.0 110.467 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -150.54 137.82 19.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.968 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.1 m 73.18 130.41 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 O-C-N 124.144 0.902 . . . . 0.0 111.444 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.493 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 20.6 p -56.38 -30.7 63.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.827 -178.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.7 m 62.82 -85.94 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.691 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -160.41 -40.97 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 3' ' ' VAL . 4.3 p-10 -137.54 -52.7 0.65 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 120.154 -0.618 . . . . 0.0 112.595 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -77.68 -9.77 59.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.115 0.483 . . . . 0.0 111.59 -174.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.493 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -76.7 -0.52 68.55 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 116.187 -0.461 . . . . 0.0 113.279 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -53.07 -25.89 14.28 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -62.78 -18.91 63.42 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.9 m -78.84 136.73 37.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.978 0.418 . . . . 0.0 109.943 175.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.48 -15.65 62.87 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.837 -174.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.401 ' CE1' ' HB2' ' A' ' 71' ' ' PRO . 2.8 t80 -88.79 20.97 3.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.982 0.42 . . . . 0.0 110.955 -176.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.64 175.42 2.92 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.953 171.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -134.9 81.7 1.91 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.892 0.377 . . . . 0.0 111.681 -176.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.466 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 92.9 m95 -121.1 137.23 26.41 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.465 177.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 7.4 Cg_exo -72.03 112.08 3.33 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.748 2.299 . . . . 0.0 111.544 177.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.509 HG13 ' HB2' ' A' ' 44' ' ' TRP . 17.4 pt -107.27 117.21 52.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.319 0.58 . . . . 0.0 110.649 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -81.58 95.69 7.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.862 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.436 ' HB ' ' CD1' ' A' ' 44' ' ' TRP . 24.7 t -118.61 125.18 74.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.288 -177.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.6 t70 62.48 28.49 16.8 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.714 0.769 . . . . 0.0 110.07 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.32 7.34 87.78 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.375 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -117.67 137.23 52.8 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.648 0.261 . . . . 0.0 110.386 -176.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.1 m -87.72 98.03 11.22 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.434 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.509 ' HB2' HG13 ' A' ' 37' ' ' ILE . 66.9 m95 -90.41 126.19 57.3 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 11.2 Cg_exo -72.15 61.16 3.24 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.852 2.368 . . . . 0.0 112.418 178.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 48' ' ' GLU . 0.5 OUTLIER 93.2 165.15 0.03 OUTLIER 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.338 1.055 . . . . 0.0 111.323 172.821 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.4 p -52.41 -43.91 65.07 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.34 -173.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.405 ' H ' HG23 ' A' ' 46' ' ' THR . 21.7 tp10 -43.56 -45.28 6.56 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 123.553 0.533 . . . . 0.0 112.205 178.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -74.34 -46.17 42.45 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.141 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -60.72 -35.57 76.66 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.152 0.501 . . . . 0.0 110.522 175.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.473 ' CZ ' ' HZ2' ' A' ' 89' ' ' TRP . 81.4 t80 -59.95 -57.45 12.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.239 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -67.3 -34.0 76.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.324 -176.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.95 -30.65 71.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.902 0.382 . . . . 0.0 111.081 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.626 ' HG2' HG22 ' A' ' 96' ' ' VAL . 24.5 tp60 -85.95 -26.89 25.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.114 0.483 . . . . 0.0 109.893 178.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -67.84 -47.87 67.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.385 -178.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -90.47 143.17 27.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.05 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.66 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.2 pt? -102.66 3.13 36.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.0 110.328 176.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.32 122.87 22.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.639 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -63.58 -51.01 67.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.655 -173.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 63' ' ' GLU . 24.9 ttpp -68.44 -34.21 75.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.817 0.341 . . . . 0.0 110.359 -177.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.658 ' O ' HG12 ' A' ' 65' ' ' ILE . 2.0 t80 -68.34 -34.53 76.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.316 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.412 ' NH2' ' HA ' ' A' ' 57' ' ' LEU . 93.6 mtt180 -62.1 -35.72 79.54 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.989 0.423 . . . . 0.0 110.193 174.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.475 ' HB3' ' O ' ' A' ' 60' ' ' LYS . 10.1 tp10 -61.2 -45.65 93.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.696 174.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -62.04 -35.16 77.76 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.547 176.693 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 61' ' ' TYR . 48.9 mm -62.51 -40.35 87.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.795 0.331 . . . . 0.0 110.766 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -90.03 -0.41 57.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.173 0.511 . . . . 0.0 110.456 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.524 ' HB2' ' HA ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -83.03 -30.31 28.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.328 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.1 m -90.96 133.46 32.62 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.136 -176.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.3 m -81.72 -38.95 24.96 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.641 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.443 ' HB2' HG23 ' A' ' 73' ' ' VAL . 17.0 m -77.9 124.77 86.18 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.266 -177.198 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.401 ' HB2' ' CE1' ' A' ' 32' ' ' PHE . 35.5 Cg_endo -65.5 -27.86 53.93 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.72 2.28 . . . . 0.0 111.724 177.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 79.6 mtp -60.2 -39.24 85.87 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.887 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.571 ' O ' ' HG2' ' A' ' 77' ' ' MET . 46.0 t -66.53 -43.62 90.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.02 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.23 -47.37 85.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.941 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.543 ' O ' ' HG3' ' A' ' 79' ' ' ARG . . . -61.1 -47.8 84.63 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.891 0.377 . . . . 0.0 111.039 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -58.25 -49.56 76.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.86 -177.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.571 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 26.0 ptt? -81.66 -11.53 59.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.79 0.329 . . . . 0.0 110.94 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -81.26 -16.51 73.97 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.013 -0.613 . . . . 0.0 111.892 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 75' ' ' ALA . 92.9 mtt180 -79.74 -10.32 59.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.554 0.216 . . . . 0.0 110.963 175.276 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.487 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 22.3 t70 -72.09 140.22 48.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.673 -176.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 87.7 mtm-85 -122.95 20.27 10.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.873 0.368 . . . . 0.0 111.274 -177.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.8 p -98.17 5.69 48.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.556 0.693 . . . . 0.0 109.187 172.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.487 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 43.6 mmtm -102.69 159.28 29.81 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.255 175.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.84 108.08 0.85 Allowed 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.262 1.974 . . . . 0.0 112.498 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 89.0 mt -98.63 151.45 20.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.216 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.623 HH21 ' ND2' ' A' ' 88' ' ' ASN . 16.4 ptm180 -96.88 140.52 31.31 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.353 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.633 ' HE2' ' HA ' ' A' ' 87' ' ' LYS . 0.6 OUTLIER -78.07 -28.3 48.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.146 0.498 . . . . 0.0 109.944 -178.289 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.623 ' ND2' HH21 ' A' ' 86' ' ' ARG . 22.9 p-10 -83.26 15.86 2.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.853 178.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.483 ' HB2' ' HG3' ' A' ' 86' ' ' ARG . 38.0 t-105 -62.41 -37.39 85.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.111 175.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.8 -31.6 72.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.939 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.3 m -71.59 -46.63 58.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.199 -178.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.503 ' O ' HG23 ' A' ' 96' ' ' VAL . 34.8 m -92.37 -1.31 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.549 -175.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.596 ' HG2' ' HZ2' ' A' ' 133' ' ' TRP . 80.8 tttt -48.57 -53.2 19.27 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 123.383 0.673 . . . . 0.0 111.292 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -66.83 -40.58 88.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.855 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 -62.15 -49.74 74.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.953 -177.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.626 HG22 ' HG2' ' A' ' 54' ' ' GLN . 77.5 t -58.08 -48.98 82.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.895 -178.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 4.4 mmt -59.6 -53.77 54.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.677 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.43 ' HD3' HD22 ' A' ' 148' ' ' LEU . 38.8 ttp85 -69.94 -29.71 66.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.456 -174.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -70.49 -42.29 71.56 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.62 0.248 . . . . 0.0 110.512 178.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.71 -43.98 87.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.094 0.473 . . . . 0.0 110.283 178.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.503 HD13 HD21 ' A' ' 149' ' ' LEU . 76.6 mt -62.38 -42.64 99.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.756 176.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.523 ' HA ' HD21 ' A' ' 152' ' ' LEU . 41.4 ttm180 -56.27 -50.17 72.11 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.159 176.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.81 -37.09 70.7 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 123.487 0.492 . . . . 0.0 111.902 -177.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -68.11 -55.6 11.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.636 0.255 . . . . 0.0 110.816 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.534 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 84.2 m-85 -70.14 -29.69 66.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.917 0.389 . . . . 0.0 111.245 -177.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -67.48 -44.35 78.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.087 0.47 . . . . 0.0 110.595 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -84.68 -31.3 24.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.967 -172.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -108.74 110.83 22.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.263 0.554 . . . . 0.0 111.019 177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.48 -26.43 66.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.531 -177.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -58.94 -49.43 77.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.456 0.646 . . . . 0.0 109.837 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.05 -36.23 66.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.337 -175.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.534 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 1.6 ttp180 -65.34 -39.16 92.03 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.506 177.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.58 -45.07 95.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.979 175.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.557 HD22 ' HB1' ' A' ' 5' ' ' ALA . 61.5 tp -60.78 -47.14 87.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.611 177.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.529 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 53.2 tp -59.31 -50.51 73.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.184 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.511 HD13 ' HG3' ' A' ' 112' ' ' ARG . 9.5 mp -73.55 -11.31 60.4 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.05 -21.19 33.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.589 0.233 . . . . 0.0 111.194 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 77.6 p -82.66 -21.56 34.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.932 0.396 . . . . 0.0 110.861 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.513 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -59.71 141.48 88.82 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.185 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.7 Cg_endo -100.08 41.33 3.83 Favored 'Cis proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.222 -1.158 . . . . 0.0 113.676 1.077 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.51 165.3 24.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.827 0.346 . . . . 0.0 110.644 177.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.518 ' HB2' HD13 ' A' ' 16' ' ' ILE . 65.8 mttt -94.8 125.34 39.39 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.251 0.548 . . . . 0.0 111.343 -177.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 62.5 mt -86.64 101.35 13.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.185 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 87.0 t -116.1 106.55 20.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.351 -179.008 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -75.68 119.66 20.0 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 175.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -88.78 77.49 7.83 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.634 0.731 . . . . 0.0 109.153 -176.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.446 ' HB ' ' HA3' ' A' ' 134' ' ' GLY . 22.5 m -96.82 105.64 17.8 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.295 176.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -98.89 -9.23 24.47 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.727 -172.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' A' ' 130' ' ' ASP . 28.2 t-20 -96.52 96.55 8.75 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 129' ' ' ASN . 5.6 m-20 69.69 154.44 0.12 Allowed 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.985 0.803 . . . . 0.0 111.214 -172.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.413 ' HB1' ' HA3' ' A' ' 141' ' ' GLY . . . -99.54 85.6 3.18 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.35 0.595 . . . . 0.0 109.478 173.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.548 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 63.6 t80 -134.97 102.29 5.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.145 -178.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.737 ' HB3' HD22 ' A' ' 145' ' ' LEU . 78.5 m95 63.53 17.6 10.48 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.845 0.716 . . . . 0.0 110.209 -172.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.446 ' HA3' ' HB ' ' A' ' 127' ' ' THR . . . -148.46 155.76 26.56 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.528 ' CG ' ' HB2' ' A' ' 143' ' ' ASN . 2.9 m-20 -88.68 34.44 0.77 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -170.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 59.18 21.33 53.14 Favored Glycine 0 C--O 1.228 -0.28 0 C-N-CA 121.187 -0.53 . . . . 0.0 112.523 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 79.08 -53.11 4.11 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.68 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -67.91 -31.41 71.16 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.646 0.609 . . . . 0.0 112.646 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 119.83 42.15 0.54 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.996 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.5 tttt -172.77 87.32 0.07 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 174.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.413 ' HA3' ' HB1' ' A' ' 131' ' ' ALA . . . -152.74 -64.75 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 119.586 -1.292 . . . . 0.0 113.398 173.103 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.548 ' HD2' ' HA ' ' A' ' 132' ' ' TYR . 58.0 mttp -164.14 43.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.879 0.34 . . . . 0.0 111.029 -174.23 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.528 ' HB2' ' CG ' ' A' ' 135' ' ' ASP . 63.9 t30 -61.1 4.95 0.07 Allowed 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 177.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.559 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 32.2 mtp180 -58.39 -24.13 59.11 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 122.167 -0.333 . . . . 0.0 110.916 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.737 HD22 ' HB3' ' A' ' 133' ' ' TRP . 47.5 tp -61.95 -50.67 71.19 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.006 0.431 . . . . 0.0 110.046 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.633 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -64.75 -32.82 85.47 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.545 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -65.44 -40.92 93.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.807 0.337 . . . . 0.0 110.437 176.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.0 mt -62.12 -38.7 89.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.004 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.503 HD21 HD13 ' A' ' 101' ' ' LEU . 77.8 mt -63.31 -36.93 85.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.82 176.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.633 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 60.8 mtt -61.73 -51.94 66.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.0 0.428 . . . . 0.0 110.128 177.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -63.37 -43.07 98.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.279 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.523 HD21 ' HA ' ' A' ' 102' ' ' ARG . 65.6 tp -61.37 -46.43 90.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.992 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.529 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 29.4 ttp85 -59.16 -39.45 82.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.713 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -65.3 -42.78 92.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.123 0.487 . . . . 0.0 110.106 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -63.59 -39.77 95.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.282 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.507 HD13 ' HD3' ' A' ' 112' ' ' ARG . 67.2 mt -78.9 -12.8 60.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.981 0.419 . . . . 0.0 110.516 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.494 ' HA ' HD21 ' A' ' 116' ' ' LEU . . . -78.66 -33.82 46.79 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.8 173.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.435 ' O ' ' HG3' ' A' ' 162' ' ' GLU . 1.4 mp -56.9 -38.28 58.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.835 177.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -63.42 -34.79 78.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.892 0.377 . . . . 0.0 110.46 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -72.79 -25.27 61.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.695 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.52 -23.72 61.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.878 0.37 . . . . 0.0 110.395 175.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 158' ' ' ILE . 46.0 mt-10 -75.98 9.47 2.42 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.376 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -77.74 -5.71 51.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.967 0.413 . . . . 0.0 110.861 177.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -93.31 122.13 35.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.648 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.433 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 46.5 m80 -94.12 -165.76 1.37 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.677 -176.127 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.433 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 51.0 m-70 70.15 37.54 1.64 Allowed 'General case' 0 N--CA 1.468 0.437 0 O-C-N 123.478 0.486 . . . . 0.0 111.369 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -157.21 103.66 2.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.819 0.342 . . . . 0.0 110.867 176.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 83.4 t60 . . . . . 0 C--O 1.244 0.813 0 CA-C-O 118.415 -0.803 . . . . 0.0 109.721 178.092 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.3 mmm . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 120.662 0.267 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -79.98 91.84 1.15 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.694 2.263 . . . . 0.0 110.222 173.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.4 t 70.74 138.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.922 -171.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 61.8 mtm-85 -81.6 48.75 1.22 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.573 0.701 . . . . 0.0 110.977 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.449 ' HB1' HD13 ' A' ' 114' ' ' LEU . . . -85.63 -174.29 5.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.483 174.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 59.83 30.92 20.46 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 123.13 0.269 . . . . 0.0 110.883 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -48.03 72.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.133 0.492 . . . . 0.0 109.939 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.4 mt -107.29 124.5 63.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -66.97 -37.27 83.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.942 0.401 . . . . 0.0 111.611 -175.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -154.01 131.67 11.46 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.954 -175.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.8 m -84.98 -178.06 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.06 0.457 . . . . 0.0 110.799 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.4 mtm -100.28 165.83 11.28 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.844 -178.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.99 112.18 3.71 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 175.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 64.84 83.06 0.17 Allowed 'General case' 0 C--N 1.331 -0.231 0 O-C-N 123.943 0.777 . . . . 0.0 110.598 -174.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.475 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 31.7 m -115.12 120.49 39.95 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.398 177.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.423 HG12 ' HB3' ' A' ' 122' ' ' LYS . 31.6 mt -96.98 107.16 19.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.325 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.6 mt -101.64 101.14 11.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.706 -175.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.524 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 38.0 m-80 -87.3 105.02 16.95 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.529 175.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -110.77 166.77 10.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.33 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -150.12 122.9 8.66 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.538 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 81.2 p 56.57 -176.57 0.05 Allowed 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.0 0.92 . . . . 0.0 111.941 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.571 HG22 ' HA ' ' A' ' 28' ' ' ASP . 40.6 p -80.86 -27.84 36.25 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -172.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.5 p 50.98 -90.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.787 0.835 . . . . 0.0 112.045 -177.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -107.56 -93.3 0.4 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -131.95 0.48 3.87 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.018 0.437 . . . . 0.0 110.77 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -101.26 -13.85 17.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.103 0.478 . . . . 0.0 110.986 -176.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.492 ' C ' ' HA ' ' A' ' 22' ' ' THR . . . -94.08 0.24 66.46 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.126 -175.023 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.571 ' HA ' HG22 ' A' ' 22' ' ' THR . 36.3 m-20 -62.11 0.95 0.35 Allowed 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -174.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -62.3 -31.22 71.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.759 0.314 . . . . 0.0 110.25 171.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 74.7 m -58.48 153.15 16.52 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.511 0.672 . . . . 0.0 112.335 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 47' ' ' SER . 94.5 m-20 -76.85 -16.45 59.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.716 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -86.42 6.28 30.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.031 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.432 ' HB1' ' HD1' ' A' ' 35' ' ' TRP . . . -59.0 146.17 39.17 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.844 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.559 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -91.21 21.1 4.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.683 -173.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.465 ' HE1' ' CG ' ' A' ' 28' ' ' ASP . 77.4 m95 -89.85 124.85 62.67 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-O 120.713 0.292 . . . . 0.0 110.959 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.443 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 36.6 Cg_endo -66.71 128.59 19.26 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.554 2.169 . . . . 0.0 111.931 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.627 HG22 ' HA ' ' A' ' 104' ' ' LYS . 16.0 pt -103.12 137.75 30.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.915 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.466 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 43.4 tptt -100.2 101.18 12.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.057 -178.249 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.433 ' O ' ' HB3' ' A' ' 40' ' ' ASP . 42.1 t -115.63 125.03 72.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.469 -178.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.433 ' HB3' ' O ' ' A' ' 39' ' ' VAL . 20.6 t70 74.96 -62.67 0.45 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.363 1.078 . . . . 0.0 110.174 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.31 28.69 0.04 OUTLIER Glycine 0 C--N 1.298 -1.53 0 CA-C-N 113.3 -1.773 . . . . 0.0 109.928 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.1 mttp -135.39 142.01 45.6 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -172.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.9 m -102.09 106.42 17.3 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.764 -175.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.479 ' HB2' HG13 ' A' ' 37' ' ' ILE . 49.4 m95 -93.25 122.34 63.4 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.587 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 44' ' ' TRP . 4.4 Cg_endo -48.26 -36.31 29.24 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.698 2.932 . . . . 0.0 114.007 -175.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.559 HG22 ' HA ' ' A' ' 34' ' ' ALA . 55.2 p -148.3 166.22 28.68 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.284 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.405 ' HB3' ' O ' ' A' ' 31' ' ' ASN . 22.9 t -63.41 -39.88 95.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.589 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.65 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 5.0 mm-40 -57.64 -37.64 73.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.834 178.076 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.415 ' CG ' ' HG2' ' A' ' 45' ' ' PRO . 25.7 m80 -60.93 -43.87 98.02 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.551 0.215 . . . . 0.0 111.332 -178.063 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -68.49 -38.83 81.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.887 0.375 . . . . 0.0 110.683 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -62.71 -45.76 91.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.616 -179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.65 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 53.0 mm-40 -70.06 -33.91 72.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.749 -178.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.34 -44.61 82.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.426 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -81.62 -12.04 58.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.309 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.585 ' HE3' ' HA ' ' A' ' 79' ' ' ARG . 51.1 tttm -65.95 -28.34 68.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.708 175.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.624 ' CE1' ' HB2' ' A' ' 83' ' ' LYS . 96.3 m-85 -110.71 166.5 10.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.182 0.515 . . . . 0.0 111.185 -178.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.627 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.2 pt? -123.25 2.71 9.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.438 175.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -76.27 138.59 40.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.649 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -62.92 -56.15 19.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.562 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -58.84 -47.56 84.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.986 -173.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.488 ' CE2' ' HG3' ' A' ' 83' ' ' LYS . 0.5 OUTLIER -72.67 -41.19 65.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.089 -172.936 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -66.36 -30.97 71.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.433 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.408 ' CD ' HH21 ' A' ' 66' ' ' ARG . 14.1 tp10 -62.93 -47.48 83.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.037 174.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -61.63 -52.59 63.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.413 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.422 HG21 ' HB2' ' A' ' 52' ' ' GLN . 65.1 mt -63.32 -27.73 43.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.682 -175.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.408 HH21 ' CD ' ' A' ' 63' ' ' GLU . 46.4 ttp180 -73.49 -34.08 65.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.762 0.315 . . . . 0.0 111.346 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -99.14 -16.62 18.54 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -173.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.98 127.93 32.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.887 0.375 . . . . 0.0 110.057 178.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 p -85.12 -35.43 21.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.772 0.32 . . . . 0.0 110.935 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.476 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 15.5 m -58.61 116.19 14.33 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.616 -178.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 10.1 Cg_exo -71.99 -44.26 0.97 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.013 2.475 . . . . 0.0 112.529 -178.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.448 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 13.7 tpt -63.55 -42.92 98.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.413 -177.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 64.9 t -65.49 -41.15 90.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.901 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.8 -44.68 90.83 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.312 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.09 -34.81 64.1 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.978 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 72' ' ' MET . 0.7 OUTLIER -65.21 -45.9 82.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.171 -176.825 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -94.14 -2.04 53.3 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.009 0.433 . . . . 0.0 110.423 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.57 -51.26 4.39 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.298 -178.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.585 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 84.5 mtm-85 -82.68 25.3 0.66 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.33 0.586 . . . . 0.0 110.747 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -73.57 157.75 36.11 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.454 174.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 52.2 mtm180 -122.89 8.7 9.36 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.1 m -68.67 -28.04 66.51 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 170.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.624 ' HB2' ' CE1' ' A' ' 56' ' ' PHE . 25.5 mmtm -94.49 154.41 40.19 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.908 177.648 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.56 171.8 14.65 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.492 2.128 . . . . 0.0 112.791 -177.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 93.8 mt -126.94 173.41 9.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.309 0.576 . . . . 0.0 111.314 -178.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -84.28 152.73 23.98 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.022 177.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -78.89 -29.43 44.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.434 0.635 . . . . 0.0 109.76 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 22.3 p30 -92.18 13.53 18.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.604 176.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.596 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 42.5 t-105 -57.72 -29.58 64.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.55 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.558 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 28.8 mm-40 -63.92 -37.58 87.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.319 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.3 t -90.35 -20.82 22.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.773 0.32 . . . . 0.0 111.837 -174.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.53 ' HA ' ' HB3' ' A' ' 95' ' ' GLN . 34.1 m -101.41 -6.05 9.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -170.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.596 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 57.3 mttp -52.62 -65.02 0.63 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.524 0.678 . . . . 0.0 110.752 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.661 ' OE2' ' HD3' ' A' ' 144' ' ' ARG . 34.9 mt-10 -86.75 -5.06 59.23 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.84 -175.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.53 ' HB3' ' HA ' ' A' ' 92' ' ' VAL . 51.7 tt0 -80.98 -47.36 13.74 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.489 175.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 53.3 t -65.9 -38.21 81.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.35 176.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.761 ' HG3' ' CH2' ' A' ' 133' ' ' TRP . 1.0 OUTLIER -61.81 -43.79 98.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.07 177.655 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -56.46 -44.93 81.0 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.175 0.512 . . . . 0.0 110.304 175.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -62.56 -43.39 98.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.562 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.83 80.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.139 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 97' ' ' MET . 69.2 mt -63.3 -43.57 97.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.585 177.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.45 ' HA ' HD21 ' A' ' 152' ' ' LEU . 76.5 ttt180 -62.79 -42.89 99.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.035 177.183 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.671 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -59.02 -45.3 91.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.609 177.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.627 ' HA ' HG22 ' A' ' 37' ' ' ILE . 37.2 ttmt -56.38 -58.84 6.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.297 -179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.433 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 91.7 m-85 -80.09 -42.56 23.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -172.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -74.83 -22.51 58.66 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.982 -0.449 . . . . 0.0 111.497 -172.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.671 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 2.8 mp0 -83.5 -37.72 22.72 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.923 176.224 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.413 ' CE1' ' HE3' ' A' ' 35' ' ' TRP . 78.6 m-70 -98.36 104.56 16.61 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.77 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.79 -30.0 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.67 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.438 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.4 mp0 -56.33 -52.04 66.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.543 0.687 . . . . 0.0 110.008 176.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 40.0 mt -78.87 -31.47 45.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.442 -176.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.776 ' HG3' HD13 ' A' ' 156' ' ' LEU . 18.9 ttt180 -63.03 -43.88 97.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.128 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.34 -35.64 78.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.444 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.449 HD13 ' HB1' ' A' ' 5' ' ' ALA . 36.1 tp -64.82 -42.82 94.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.404 178.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.53 HD23 HD12 ' A' ' 156' ' ' LEU . 61.0 tp -62.36 -41.2 98.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.209 0.528 . . . . 0.0 110.726 178.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 87.1 mt -77.7 -14.12 59.7 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.976 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -81.1 -34.61 32.48 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.544 176.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 22.9 p -75.14 -11.92 60.19 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.213 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -57.38 134.59 81.6 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.502 174.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.2 Cg_endo -106.24 69.37 0.23 Allowed 'Cis proline' 0 C--N 1.354 0.817 0 CA-C-N 118.917 0.649 . . . . 0.0 113.112 -5.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -88.85 158.4 18.12 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.423 ' HB3' HG12 ' A' ' 16' ' ' ILE . 20.8 ttmm -88.19 105.95 17.87 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 176.648 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 29.5 mt -81.09 119.14 23.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.126 -173.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.524 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 47.3 t -134.95 123.6 41.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.9 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -98.85 137.09 37.92 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 172.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.418 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 81.1 t60 -98.91 77.56 2.22 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -177.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 5.7 t -100.01 94.98 6.55 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 122.298 1.047 . . . . 0.0 111.649 -173.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.505 ' HB3' ' HA3' ' A' ' 137' ' ' GLY . 3.0 pt-20 -83.27 14.36 3.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.894 170.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -82.37 -51.92 7.4 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.489 -1.232 . . . . 0.0 108.886 173.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -144.46 108.38 4.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.804 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.3 85.91 4.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.996 0.427 . . . . 0.0 111.182 -177.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.58 ' O ' ' HB3' ' A' ' 142' ' ' LYS . 35.5 t80 -169.17 -28.41 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.659 177.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.776 ' HB3' HD22 ' A' ' 145' ' ' LEU . 47.3 m95 -111.8 77.22 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.529 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 112.39 -140.43 16.23 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 -178.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.403 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 6.2 t0 -86.53 133.02 33.77 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 117.03 0.415 . . . . 0.0 110.222 176.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -84.55 32.33 3.4 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.127 -0.559 . . . . 0.0 112.804 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.505 ' HA3' ' HB3' ' A' ' 128' ' ' GLU . . . 80.95 13.45 81.2 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 121.185 -0.531 . . . . 0.0 114.091 174.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -154.35 12.15 0.41 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.955 0.877 . . . . 0.0 112.744 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 98.86 5.37 56.55 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 121.042 -0.599 . . . . 0.0 114.096 172.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -167.32 97.27 0.5 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 117.257 0.529 . . . . 0.0 111.253 176.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.33 -64.91 0.2 Allowed Glycine 0 C--N 1.31 -0.863 0 C-N-CA 120.481 -0.866 . . . . 0.0 111.332 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 132' ' ' TYR . 37.6 tttm -177.96 83.86 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.27 5.28 0.57 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.187 -174.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.661 ' HD3' ' OE2' ' A' ' 94' ' ' GLU . 51.2 ttt180 -62.48 -24.13 67.3 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -175.062 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.776 HD22 ' HB3' ' A' ' 133' ' ' TRP . 31.1 tp -58.57 -50.77 72.6 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 175.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.585 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -66.52 -28.62 73.84 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.925 176.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -68.78 -38.7 80.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.755 0.312 . . . . 0.0 110.328 177.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 96.3 mt -61.16 -37.55 83.28 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 174.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 153' ' ' ARG . 96.0 mt -64.9 -37.88 89.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.511 176.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.585 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 58.2 mtt -63.0 -51.77 65.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.875 0.369 . . . . 0.0 110.166 176.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -59.11 -44.41 91.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.459 -178.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 55.7 tp -67.11 -40.24 86.83 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.009 178.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.828 HH11 ' HB3' ' A' ' 153' ' ' ARG . 1.4 ttp-105 -57.8 -43.56 85.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.465 -179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.18 -46.42 82.84 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.278 175.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.0 -51.39 69.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.518 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.776 HD13 ' HG3' ' A' ' 112' ' ' ARG . 20.9 mt -63.33 -30.78 71.85 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.909 -175.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -69.0 -48.15 63.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.324 175.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.552 ' O ' ' HG3' ' A' ' 162' ' ' GLU . 81.7 mt -64.01 -39.05 84.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.202 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -56.11 -47.21 78.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.978 0.418 . . . . 0.0 110.552 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -84.05 -15.95 45.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.117 0.484 . . . . 0.0 110.418 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 14.4 tp -72.38 -19.06 61.68 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 175.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.552 ' HG3' ' O ' ' A' ' 158' ' ' ILE . 42.0 mt-10 -74.64 10.83 1.2 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.998 176.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -57.69 94.83 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.57 0.7 . . . . 0.0 111.591 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -114.87 90.67 3.4 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.308 0.575 . . . . 0.0 110.888 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 63.74 12.06 6.34 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.401 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 22.8 t-160 -63.2 -42.69 99.35 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 176.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -137.95 -38.84 0.56 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 168.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 . . . . . 0 C--O 1.247 0.968 0 CA-C-N 114.637 -1.165 . . . . 0.0 108.521 177.544 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.402 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 63.6 mtt . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.567 -0.16 . . . . 0.0 110.567 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 1' ' ' MET . 17.4 Cg_exo -66.6 -44.85 5.52 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.226 1.951 . . . . 0.0 110.141 171.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 20.4 t -103.6 100.97 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.68 173.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -87.39 101.03 13.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.887 0.375 . . . . 0.0 111.013 -173.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.78 124.88 30.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.263 177.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -149.96 149.91 31.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.755 0.312 . . . . 0.0 110.362 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.422 ' HE ' ' HB2' ' A' ' 7' ' ' ARG . 17.4 mtm180 -89.7 121.45 31.88 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.091 -175.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.9 tt -98.66 114.25 35.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.48 0.657 . . . . 0.0 109.318 169.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.13 168.51 16.68 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.856 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.1 m170 59.55 59.68 2.51 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -173.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.429 HG21 ' HD2' ' A' ' 120' ' ' PRO . 29.1 m -83.46 15.27 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.727 -173.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 38.5 mtm 63.94 40.9 6.98 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.537 171.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 70.43 -69.4 0.18 Allowed 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.709 0.631 . . . . 0.0 111.733 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -140.18 87.78 2.17 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.61 -174.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.4 t -101.65 142.08 33.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.119 176.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.422 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.0 mp -96.15 105.61 17.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.4 mt -89.85 115.26 29.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.034 0.445 . . . . 0.0 110.347 -175.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -93.93 108.68 20.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.43 -177.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 31.4 p90 -114.25 113.79 25.09 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.086 0.47 . . . . 0.0 110.394 177.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.512 ' O ' ' HB2' ' A' ' 21' ' ' SER . 16.9 t80 -150.17 100.22 2.88 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 174.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 33.8 t 161.34 115.58 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.23 0 O-C-N 124.205 0.941 . . . . 0.0 109.008 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 m -87.94 2.47 51.56 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.241 0.543 . . . . 0.0 110.245 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.9 m -110.1 20.03 18.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.05 -177.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -126.29 157.63 37.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.966 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.91 -33.06 74.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.868 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -87.62 -1.52 58.01 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.6 0.714 . . . . 0.0 109.86 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.25 -0.29 56.61 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.261 -177.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -51.69 -30.74 23.28 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -72.9 -0.79 14.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.734 0.302 . . . . 0.0 111.701 -177.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.9 t -75.06 139.78 43.05 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -77.63 -3.2 39.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.004 0.431 . . . . 0.0 110.573 178.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -106.77 12.01 29.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.37 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.2 137.14 57.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.855 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.94 58.18 2.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.297 0.57 . . . . 0.0 111.595 -174.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.417 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 95.9 m95 -112.0 118.81 45.62 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.966 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 35' ' ' TRP . 36.9 Cg_endo -66.78 134.53 35.2 Favored 'Trans proline' 0 C--O 1.239 0.534 0 C-N-CA 122.624 2.216 . . . . 0.0 111.501 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.548 HG22 ' HA ' ' A' ' 104' ' ' LYS . 29.8 pt -121.85 155.84 26.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.101 0.477 . . . . 0.0 110.925 -176.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.596 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 1.2 tmtp? -117.31 107.07 13.95 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 -178.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.4 ' C ' ' H ' ' A' ' 41' ' ' GLY . 7.7 t -127.21 127.88 69.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.072 -173.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 27.6 t70 73.64 -19.94 0.32 Allowed 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.712 0.633 . . . . 0.0 111.84 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.539 ' HA2' ' HE2' ' A' ' 38' ' ' LYS . . . 125.79 1.86 7.47 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 -171.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -109.52 134.98 51.25 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.241 -0.48 . . . . 0.0 110.1 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.3 m -84.17 116.5 22.95 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.167 176.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.48 ' HB2' HG13 ' A' ' 37' ' ' ILE . 80.0 m95 -106.06 130.74 22.51 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.837 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.65 -26.16 69.02 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.695 2.263 . . . . 0.0 112.945 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.81 ' HB ' ' OE1' ' A' ' 48' ' ' GLU . 0.1 OUTLIER -159.71 173.7 15.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.329 -178.044 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.0 m -77.87 -48.34 16.65 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -171.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.81 ' OE1' ' HB ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -59.94 -25.97 65.59 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.178 -178.844 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.493 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 54.3 m80 -59.82 -43.4 94.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.005 176.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -67.22 -44.69 78.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.945 0.402 . . . . 0.0 110.074 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -60.87 -46.59 90.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.638 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.47 ' CG ' ' HA3' ' A' ' 78' ' ' GLY . 2.4 tp-100 -65.08 -32.4 74.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.809 -177.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.408 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -73.74 -46.06 48.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.53 -178.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -77.83 -9.54 59.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.181 0.515 . . . . 0.0 110.756 -177.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.413 ' HA ' ' CZ3' ' A' ' 89' ' ' TRP . 86.8 tttt -63.43 -29.17 70.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.045 175.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -109.17 167.09 10.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.78 -177.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.444 HD11 ' HG2' ' A' ' 86' ' ' ARG . 5.2 mp -96.57 -37.19 10.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.934 -176.502 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.556 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 24.5 t70 -63.38 126.63 28.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.822 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.63 -32.37 67.88 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -173.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.8 ttpp -64.35 -40.9 96.77 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.16 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.479 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 0.5 OUTLIER -66.45 -32.25 73.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.712 -179.628 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.556 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 65.0 mtt180 -63.67 -45.2 91.21 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.368 0.604 . . . . 0.0 109.556 176.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -77.59 -16.36 58.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.386 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.479 ' HB2' ' HA ' ' A' ' 61' ' ' TYR . 6.3 tp10 -66.82 -45.81 77.13 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.53 ' O ' HG12 ' A' ' 68' ' ' VAL . 1.9 mp -70.79 -31.4 45.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.731 175.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.4 ' HG2' ' O ' ' A' ' 66' ' ' ARG . 70.8 ttt180 -72.57 -11.54 60.69 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.009 0.433 . . . . 0.0 110.644 175.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -85.24 -7.95 58.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.132 0.491 . . . . 0.0 110.402 -177.901 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.56 HG21 ' HB ' ' A' ' 73' ' ' VAL . 7.5 p -115.36 138.43 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.792 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 39.3 t -90.35 -32.41 16.48 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.798 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.457 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 31.4 t -68.71 121.41 81.06 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.708 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.493 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 22.4 Cg_exo -66.05 -32.83 43.15 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.121 2.547 . . . . 0.0 112.26 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 46.3 ttm -67.8 -41.44 83.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.696 -177.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.56 ' HB ' HG21 ' A' ' 68' ' ' VAL . 87.1 t -66.3 -36.2 76.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.447 178.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.43 -44.28 95.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.247 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.417 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -63.44 -39.43 94.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.73 177.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -56.51 -53.84 52.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.693 178.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 54.0 mtm -70.56 -30.54 67.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.914 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.47 ' HA3' ' CG ' ' A' ' 52' ' ' GLN . . . -81.95 -7.22 88.19 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.943 -178.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 40.9 ttt180 -89.24 -0.94 57.85 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 122.539 -0.389 . . . . 0.0 110.627 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.443 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 30.2 t70 -71.12 112.38 7.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.047 0.451 . . . . 0.0 110.499 -179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -96.16 10.82 36.5 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.325 0.583 . . . . 0.0 110.16 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 m -74.13 -24.4 59.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.643 176.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.443 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 49.2 mmtm -75.78 147.0 80.62 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.576 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -62.51 120.58 8.18 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.319 2.013 . . . . 0.0 111.215 173.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 89.4 mt -86.74 150.95 23.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.804 -176.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.572 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 22.7 mtp180 -68.83 130.63 43.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.36 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -58.06 -43.09 86.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.976 0.417 . . . . 0.0 111.603 -177.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -103.32 33.23 3.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.835 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.572 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 43.8 t-105 -60.09 -40.11 88.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.776 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.477 ' HA ' ' HE3' ' A' ' 93' ' ' LYS . 12.4 pt-20 -68.23 -23.38 64.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.697 0.284 . . . . 0.0 111.211 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.0 m -84.38 -20.15 32.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.15 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.6 m -114.3 6.99 7.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 110.607 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.477 ' HE3' ' HA ' ' A' ' 90' ' ' GLU . 38.4 ttmt -58.78 -53.01 63.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.649 -176.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -25.5 49.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.469 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.823 ' HA ' ' HD2' ' A' ' 98' ' ' ARG . 34.0 tt0 -58.68 -56.06 27.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.631 174.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.9 -43.99 96.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.823 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 47.0 ttm -65.05 -43.92 90.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.774 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.823 ' HD2' ' HA ' ' A' ' 95' ' ' GLN . 0.8 OUTLIER -66.65 -29.32 69.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.441 -178.535 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.446 ' N ' ' HG2' ' A' ' 98' ' ' ARG . 88.3 tttt -71.12 -42.79 68.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.021 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.62 87.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.428 176.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.407 ' HA ' HD23 ' A' ' 101' ' ' LEU . 22.4 mt -60.91 -41.76 96.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.227 178.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.705 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 58.4 ttt180 -61.01 -48.65 80.83 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 120.383 -0.527 . . . . 0.0 109.882 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -55.9 -36.69 67.94 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.115 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.548 ' HA ' HG22 ' A' ' 37' ' ' ILE . 63.5 tttm -59.21 -50.61 73.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.171 178.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -81.79 -26.21 34.6 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -177.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.705 ' HG3' ' HG2' ' A' ' 102' ' ' ARG . 5.9 mm-40 -74.98 -35.79 62.04 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.729 0.3 . . . . 0.0 111.759 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.596 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 77.2 mm-40 -84.21 -11.46 56.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.985 0.422 . . . . 0.0 110.905 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -129.2 99.21 5.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.811 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -59.67 -29.9 68.39 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.486 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.9 mp0 -53.26 -51.79 61.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.074 175.314 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 29.0 mt -75.42 -33.7 60.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.48 -176.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 24.6 ttt-85 -57.96 -41.77 83.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.114 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.7 -43.12 73.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.792 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 63.7 tp -57.11 -44.28 83.11 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.784 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.441 HD23 HD12 ' A' ' 156' ' ' LEU . 40.5 tp -62.76 -45.89 90.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.274 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 156' ' ' LEU . 79.0 mt -70.37 -18.28 63.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.719 0.295 . . . . 0.0 111.629 -176.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -73.9 -21.9 59.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.631 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.1 p -75.67 -27.28 58.26 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -176.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.518 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -48.78 137.78 12.76 Favored Pre-proline 0 N--CA 1.467 0.379 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.429 ' HD2' HG21 ' A' ' 11' ' ' VAL . 94.5 Cg_endo -100.75 33.74 8.3 Favored 'Cis proline' 0 N--CA 1.458 -0.588 0 C-N-CA 124.554 -1.019 . . . . 0.0 112.941 -2.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -62.84 159.42 16.65 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.976 0.417 . . . . 0.0 111.688 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -90.5 119.05 30.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.114 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.416 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 60.5 mt -86.4 113.48 22.39 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.757 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 95.7 t -131.9 126.8 57.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.084 0.469 . . . . 0.0 111.285 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.568 ' OE1' ' HA3' ' A' ' 134' ' ' GLY . 0.0 OUTLIER -83.31 141.73 31.6 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 172.777 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -120.04 77.51 1.25 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.374 -174.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 2.2 m -78.33 137.49 38.08 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.601 171.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 45.6 mp0 -120.49 -1.36 10.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.74 0.305 . . . . 0.0 110.658 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -94.57 -5.43 45.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.885 0.374 . . . . 0.0 111.297 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.791 ' O ' ' HA2' ' A' ' 136' ' ' GLY . 4.8 t70 -178.48 -165.01 0.08 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.06 86.2 2.23 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.88 0.371 . . . . 0.0 110.133 175.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.549 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 4.7 t80 -155.13 122.29 5.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.584 -175.607 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.433 ' HZ2' ' HG2' ' A' ' 93' ' ' LYS . 28.8 m95 64.03 20.62 12.28 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.78 0.675 . . . . 0.0 112.513 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.568 ' HA3' ' OE1' ' A' ' 125' ' ' GLU . . . -176.01 -114.85 0.39 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.232 -0.985 . . . . 0.0 112.279 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -112.79 173.14 6.52 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 120.698 0.285 . . . . 0.0 110.794 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.791 ' HA2' ' O ' ' A' ' 130' ' ' ASP . . . -120.95 21.11 8.42 Favored Glycine 0 N--CA 1.444 -0.821 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 175.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.6 44.12 4.99 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.425 -0.417 . . . . 0.0 113.26 178.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -174.15 -35.34 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 117.164 0.482 . . . . 0.0 112.207 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 131.01 36.41 0.35 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.893 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt 179.32 89.99 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.816 0.341 . . . . 0.0 110.804 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.589 ' O ' ' HG3' ' A' ' 142' ' ' LYS . . . -123.93 -65.13 0.2 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 119.664 -1.255 . . . . 0.0 112.124 174.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.589 ' HG3' ' O ' ' A' ' 141' ' ' GLY . 47.6 mttp -166.17 79.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 123.697 0.799 . . . . 0.0 109.2 177.214 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -71.1 4.99 2.32 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.511 -173.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.692 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 6.9 tpp180 -49.63 -38.64 32.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.226 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.56 -58.5 7.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.962 -178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.416 ' HA3' ' O ' ' A' ' 123' ' ' LEU . . . -62.49 -29.88 74.8 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.945 -0.645 . . . . 0.0 111.752 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' TYR . . . . . 0.437 ' O ' ' HG2' ' A' ' 151' ' ' GLU . 11.4 t80 -67.21 -40.67 86.45 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.1 mt -61.06 -41.49 96.7 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.895 0.379 . . . . 0.0 110.174 175.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.8 mt -61.15 -36.76 80.64 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.863 177.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 77.8 mtm -77.58 -34.78 53.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.972 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 147' ' ' TYR . 7.3 mm-40 -59.72 -48.26 82.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.457 0.646 . . . . 0.0 109.48 172.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.522 HD11 ' HG3' ' A' ' 102' ' ' ARG . 54.3 tp -64.56 -37.63 88.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.793 179.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.674 ' HG2' HH11 ' A' ' 153' ' ' ARG . 30.9 ttp85 -61.04 -41.34 96.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.988 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -67.28 -33.95 76.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.084 0.468 . . . . 0.0 110.461 176.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -65.32 -53.18 47.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.901 177.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.533 ' HB2' HD21 ' A' ' 116' ' ' LEU . 55.2 mt -68.0 -23.59 65.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.93 -175.029 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.518 ' O ' ' HB3' ' A' ' 160' ' ' LYS . . . -64.43 -48.81 73.92 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.494 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.08 -37.42 80.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.771 0.319 . . . . 0.0 110.616 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.69 -24.19 66.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.019 0.438 . . . . 0.0 110.725 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' A' ' 157' ' ' ALA . 53.3 tttp -68.1 -26.73 65.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.257 176.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.4 mp -78.64 -35.69 45.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.248 0.547 . . . . 0.0 109.935 176.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -84.43 11.54 8.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.435 -178.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 4.8 p80 -62.75 -15.99 55.78 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.737 0.303 . . . . 0.0 110.932 -178.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -60.84 112.1 1.91 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.22 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.2 t60 59.94 24.16 13.27 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.06 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 27.9 t60 -76.19 -25.58 55.33 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 63.7 t-80 -147.03 93.26 2.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.462 172.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 36.7 t60 . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.727 -0.654 . . . . 0.0 109.357 178.234 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 120.736 0.303 . . . . 0.0 110.479 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -87.6 150.1 7.51 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 122.821 2.348 . . . . 0.0 113.202 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.7 p -167.17 94.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.902 0.858 . . . . 0.0 109.988 175.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.527 ' HB3' ' CG ' ' A' ' 25' ' ' ASP . 42.3 ttm105 -105.6 37.89 2.12 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.772 0.796 . . . . 0.0 110.195 -176.077 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.419 ' HB1' HD13 ' A' ' 114' ' ' LEU . . . -78.37 29.4 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.2 -176.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -122.55 25.47 8.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.785 0.326 . . . . 0.0 110.789 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -75.02 -52.88 9.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.516 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 68.5 mt -105.55 111.27 34.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.437 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -89.49 85.81 6.61 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.691 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 65.23 118.12 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.332 0.587 . . . . 0.0 111.588 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.518 HG21 ' HB2' ' A' ' 121' ' ' ALA . 34.4 m -68.59 163.14 3.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.542 176.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.428 ' SD ' ' N ' ' A' ' 12' ' ' MET . 0.0 OUTLIER -81.2 -79.9 0.15 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.814 -173.831 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.0 tp60 -171.46 119.74 0.47 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.391 -0.822 . . . . 0.0 108.925 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.8 t70 59.58 88.11 0.08 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.596 0.713 . . . . 0.0 110.198 -172.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.54 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 9.2 m -134.44 117.02 15.82 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.582 -179.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.465 ' H ' HD12 ' A' ' 16' ' ' ILE . 4.2 mp -82.95 100.77 6.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.469 HD11 HG11 ' A' ' 11' ' ' VAL . 62.9 mt -89.81 108.75 19.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.266 -177.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.616 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.6 m-20 -92.81 106.64 18.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.598 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.648 ' CE2' ' HB2' ' A' ' 125' ' ' GLU . 39.6 p90 -105.02 151.33 24.08 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 174.034 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.671 ' CE1' ' HA ' ' A' ' 127' ' ' THR . 1.7 t80 -150.1 108.04 3.72 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.436 -0.505 . . . . 0.0 111.923 -176.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.7 m 73.68 171.14 0.3 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.614 0.721 . . . . 0.0 112.247 173.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.0 p -82.43 3.05 29.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.997 -1.001 . . . . 0.0 112.222 -172.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.7 p -76.12 23.39 0.14 Allowed 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -174.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -156.92 163.66 38.9 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 -178.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.527 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 5.7 m-20 -61.24 -35.71 77.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.264 0.554 . . . . 0.0 109.901 175.215 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.426 ' CE1' HD11 ' A' ' 114' ' ' LEU . 92.2 m-85 -77.74 -1.95 33.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.354 177.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.27 -4.15 67.8 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.08 177.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -68.78 -22.85 64.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.423 0.63 . . . . 0.0 110.093 174.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -68.5 -24.86 64.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.475 176.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.0 m -71.98 134.11 45.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.739 175.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -54.97 -23.63 20.14 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -174.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.62 -52.96 17.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 176.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 42.25 -157.2 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.863 0.865 . . . . 0.0 112.992 -176.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -157.86 22.63 0.27 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.737 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.422 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 84.1 m95 -112.99 125.58 29.58 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.935 -177.19 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 24.5 Cg_exo -64.38 143.24 82.04 Favored 'Trans proline' 0 C--O 1.238 0.485 0 C-N-CA 122.844 2.363 . . . . 0.0 112.41 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.652 HG22 ' HA ' ' A' ' 104' ' ' LYS . 32.2 pt -121.92 153.0 25.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.523 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.414 ' HE3' ' O ' ' A' ' 41' ' ' GLY . 37.9 tptt -116.17 95.43 5.08 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 t -107.81 117.42 53.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.291 -178.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.6 t70 69.13 5.01 4.84 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.584 0.707 . . . . 0.0 110.632 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.414 ' O ' ' HE3' ' A' ' 38' ' ' LYS . . . 104.67 -2.34 42.18 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.469 -175.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 51.6 mttm -94.25 125.45 38.89 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.66 ' HB ' HH21 ' A' ' 66' ' ' ARG . 35.2 m -82.82 109.72 17.21 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.863 0.363 . . . . 0.0 110.602 178.073 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.436 ' HB2' ' CG1' ' A' ' 37' ' ' ILE . 57.6 m95 -101.84 129.04 27.37 Favored Pre-proline 0 C--N 1.318 -0.773 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 174.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.472 ' CG ' ' HA ' ' A' ' 69' ' ' SER . 52.4 Cg_exo -53.78 -22.57 23.77 Favored 'Trans proline' 0 N--CA 1.475 0.431 0 C-N-CA 123.026 2.484 . . . . 0.0 113.338 -176.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 15.4 t -179.31 173.37 1.12 Allowed 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 175.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.73 -32.57 71.83 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -175.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -50.02 -43.37 50.68 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.559 0.343 . . . . 0.0 111.335 175.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -69.13 -30.13 68.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.168 -175.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -76.02 -31.65 59.0 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -64.02 -52.38 59.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.948 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -63.6 -41.03 98.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.653 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.784 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -67.04 -27.69 67.61 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -100.49 -7.15 24.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.657 0.265 . . . . 0.0 110.988 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.545 ' HA ' ' CZ3' ' A' ' 89' ' ' TRP . 83.2 tttt -62.62 -39.59 94.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.333 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -107.36 160.79 15.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.115 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.754 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.6 pt? -95.73 28.9 2.84 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 168.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -97.68 106.58 18.91 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.105 -1.407 . . . . 0.0 109.895 -176.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 2.4 mp0 -64.69 -35.8 82.2 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.346 -178.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -63.79 -47.6 80.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.797 0.332 . . . . 0.0 110.809 -177.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.552 ' O ' HG12 ' A' ' 65' ' ' ILE . 0.1 OUTLIER -68.77 -29.55 67.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.367 -178.145 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.784 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 38.4 ttm180 -60.99 -41.9 97.38 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.127 0.489 . . . . 0.0 109.754 176.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 45.0 mt-10 -65.7 -39.51 91.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.117 176.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.26 -36.99 63.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.154 -174.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 61' ' ' TYR . 41.1 mm -63.56 -33.47 61.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 174.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.66 HH21 ' HB ' ' A' ' 43' ' ' THR . 0.4 OUTLIER -73.25 -25.31 60.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.271 178.04 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 58.0 mtt-85 -70.28 -33.24 71.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.643 0.259 . . . . 0.0 111.204 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.4 m -92.29 134.88 29.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.239 0.542 . . . . 0.0 111.417 -175.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.472 ' HA ' ' CG ' ' A' ' 45' ' ' PRO . 5.0 p -88.78 -21.32 23.85 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.479 175.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 44.5 t -78.47 126.18 83.42 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.741 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -72.34 -32.29 10.46 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.636 2.224 . . . . 0.0 112.008 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.9 tpt -69.82 -38.36 76.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.266 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 95.5 t -68.32 -39.09 80.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.565 177.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.98 -52.2 57.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.658 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.14 -35.77 74.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.044 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 30.5 ttt85 -62.33 -39.98 94.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.742 0.306 . . . . 0.0 110.689 177.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 72.4 mtm -74.02 -34.93 64.32 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.03 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.49 6.37 77.74 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.469 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -63.25 -42.3 99.16 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -86.95 176.9 7.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.831 0.348 . . . . 0.0 111.482 -170.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -115.18 5.42 14.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.046 -174.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 49.9 m -64.75 -27.3 68.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.884 0.373 . . . . 0.0 111.294 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.498 ' HE3' ' CE2' ' A' ' 61' ' ' TYR . 0.2 OUTLIER -89.49 147.22 37.48 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -50.27 112.55 0.76 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.164 2.576 . . . . 0.0 113.97 -173.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 97.0 mt -88.47 155.17 19.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.023 175.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 -95.76 143.77 26.71 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.747 0.308 . . . . 0.0 110.497 -178.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -79.45 -28.64 41.62 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.177 0.513 . . . . 0.0 110.28 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -85.47 11.9 9.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.621 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.545 ' CZ3' ' HA ' ' A' ' 55' ' ' LYS . 60.7 t-105 -60.39 -19.45 55.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.333 0.587 . . . . 0.0 110.138 176.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.612 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 17.9 mm-40 -68.11 -40.38 82.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.488 175.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.0 p -100.02 -1.0 38.12 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -172.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.484 HG22 ' HA ' ' A' ' 89' ' ' TRP . 34.7 m -112.37 0.8 8.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -177.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.612 ' NZ ' ' HA ' ' A' ' 90' ' ' GLU . 50.7 mttp -61.04 -54.92 38.83 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.286 0.565 . . . . 0.0 109.944 179.497 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -67.74 -28.66 67.83 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.471 -178.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -69.94 -54.09 14.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.744 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.4 t -62.22 -43.99 98.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.636 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.09 -50.15 74.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.886 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.5 ttm-85 -60.01 -43.11 95.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.899 0.381 . . . . 0.0 110.866 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -66.48 -48.01 71.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.919 -178.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.11 -37.98 89.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.88 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.425 HD13 ' CD2' ' A' ' 149' ' ' LEU . 90.0 mt -67.5 -43.06 81.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.107 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.522 ' HG3' HD11 ' A' ' 152' ' ' LEU . 10.9 ttt-85 -61.55 -46.55 89.46 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.956 178.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -63.91 -24.48 67.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.097 -179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.652 ' HA ' HG22 ' A' ' 37' ' ' ILE . 28.1 ttpp -76.74 -49.6 15.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.547 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.595 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 77.4 m-85 -71.6 -27.55 63.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.327 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.431 ' HA ' HH11 ' A' ' 112' ' ' ARG . 25.6 mt-10 -73.83 -35.4 64.84 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.613 173.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.538 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 45.3 tp60 -66.81 -34.66 78.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.061 -177.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.447 ' HB3' ' OE2' ' A' ' 110' ' ' GLU . 97.0 m-70 -121.4 109.59 15.06 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.459 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.76 -33.25 73.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.778 -177.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.0 OUTLIER -72.44 -29.9 64.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.77 -179.044 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 76.2 mt -74.61 -38.64 62.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.04 0.447 . . . . 0.0 109.893 175.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.595 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 30.6 ttp-105 -62.89 -43.53 98.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.045 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.69 72.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.722 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.426 HD11 ' CE1' ' A' ' 26' ' ' TYR . 66.4 tp -66.27 -48.17 71.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.943 0.401 . . . . 0.0 110.257 176.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.495 HD23 HD12 ' A' ' 156' ' ' LEU . 42.7 tp -59.41 -44.89 92.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.013 178.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 51.3 mt -74.94 -15.96 60.66 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.476 -177.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.3 -21.14 56.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.894 0.378 . . . . 0.0 110.752 176.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.417 ' O ' ' HB3' ' A' ' 121' ' ' ALA . 43.8 p -85.97 -5.95 59.13 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 121.05 0.453 . . . . 0.0 110.559 178.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.07 143.21 65.3 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.282 174.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -99.34 46.56 2.36 Favored 'Cis proline' 0 N--CA 1.456 -0.687 0 C-N-CA 124.397 -1.085 . . . . 0.0 113.56 -0.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.54 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -78.73 176.53 9.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.588 0.232 . . . . 0.0 110.761 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.413 ' HG3' ' SD ' ' A' ' 150' ' ' MET . 35.1 ttpt -108.69 127.82 54.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.271 -176.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 27.8 mt -93.16 120.46 33.48 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.27 -172.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 99.0 t -139.42 120.3 15.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.047 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.648 ' HB2' ' CE2' ' A' ' 19' ' ' PHE . 31.8 tt0 -93.88 129.86 40.15 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 172.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.501 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 8.4 t60 -97.63 77.6 2.58 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -176.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.671 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -77.17 92.22 3.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.065 -179.859 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.421 ' HB2' ' HD2' ' A' ' 126' ' ' HIS . 20.3 tt0 -95.53 -15.01 23.16 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.225 -174.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -88.61 -34.08 17.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.542 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.543 ' O ' ' HB ' ' A' ' 127' ' ' THR . 34.3 t70 -142.19 110.28 5.93 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.101 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.524 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -79.09 85.94 4.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.919 -172.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.518 ' CE2' ' HD3' ' A' ' 142' ' ' LYS . 7.4 t80 -169.55 147.36 3.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.522 172.378 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.456 ' HB3' HD22 ' A' ' 145' ' ' LEU . 18.5 m95 68.53 13.6 8.97 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 123.746 0.654 . . . . 0.0 111.693 178.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -160.44 -155.59 7.83 Favored Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 119.929 -1.129 . . . . 0.0 112.71 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.501 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 15.3 t70 -66.43 -29.02 69.07 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.224 0.535 . . . . 0.0 110.696 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.638 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 78.06 0.41 76.2 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.62 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.441 ' HA2' ' NE2' ' A' ' 126' ' ' HIS . . . 88.26 9.37 70.13 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.491 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -170.3 25.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 111.186 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 86.54 -51.97 4.41 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.288 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -88.67 65.25 7.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.3 0.572 . . . . 0.0 111.119 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.638 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -123.32 14.49 8.25 Favored Glycine 0 C--N 1.315 -0.616 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.379 173.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.518 ' HD3' ' CE2' ' A' ' 132' ' ' TYR . 22.2 mtpp 61.36 79.9 0.24 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.211 0.604 . . . . 0.0 111.071 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -75.38 5.33 5.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.276 -176.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.668 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 1.2 ttm180 -32.76 -37.42 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.43 1.092 . . . . 0.0 112.665 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.456 HD22 ' HB3' ' A' ' 133' ' ' TRP . 45.4 tp -61.37 -52.65 63.76 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.611 0.243 . . . . 0.0 111.126 -178.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -63.17 -27.01 69.88 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.701 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -71.33 -43.34 67.2 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.668 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 75.1 mt -61.71 -41.21 97.3 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 175.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.425 ' CD2' HD13 ' A' ' 101' ' ' LEU . 60.8 mt -61.3 -38.83 88.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.813 175.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.413 ' SD ' ' HG3' ' A' ' 122' ' ' LYS . 62.4 mtm -70.09 -38.95 75.82 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.212 178.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.0 -46.13 90.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.026 0.441 . . . . 0.0 109.887 174.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.522 HD11 ' HG3' ' A' ' 102' ' ' ARG . 45.7 tp -63.29 -42.06 99.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.642 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.938 HH11 ' HB3' ' A' ' 153' ' ' ARG . 1.0 OUTLIER -60.01 -42.49 94.39 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.672 176.856 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.63 -44.68 93.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.226 0.536 . . . . 0.0 109.858 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -65.12 -41.42 94.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.143 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.495 HD12 HD23 ' A' ' 115' ' ' LEU . 79.3 mt -76.28 -22.57 54.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.706 -0.225 . . . . 0.0 110.569 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -67.24 -44.37 79.63 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 172.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 75.2 mt -63.6 -40.12 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.876 174.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -63.52 -32.42 73.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.217 177.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -74.58 -44.07 52.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.795 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.12 -16.93 49.68 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.641 175.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.418 ' O ' ' N ' ' A' ' 164' ' ' HIS . 0.7 OUTLIER -79.1 11.61 2.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.544 177.319 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.44 ' O ' ' CD2' ' A' ' 163' ' ' HIS . 18.9 p-80 -54.4 76.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.72 0.771 . . . . 0.0 111.547 171.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' HIS . . . . . 0.418 ' N ' ' O ' ' A' ' 162' ' ' GLU . 31.9 m80 -147.64 173.83 12.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.066 -178.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -105.62 76.14 1.18 Allowed 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 159.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -52.67 -47.8 66.94 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.04 -1.436 . . . . 0.0 111.596 -169.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -137.81 -29.81 0.84 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.504 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 74.6 t60 . . . . . 0 C--O 1.245 0.862 0 CA-C-O 118.353 -0.832 . . . . 0.0 109.957 178.398 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.4 tpp . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -76.53 19.25 0.65 Allowed 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.938 1.759 . . . . 0.0 113.166 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.466 HG21 ' HB3' ' A' ' 110' ' ' GLU . 8.4 p 43.69 89.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 124.714 1.206 . . . . 0.0 113.187 178.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -101.66 -31.91 10.58 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.889 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 56.0 68.79 0.81 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.513 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -68.06 127.24 32.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.432 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.5 mtm-85 -98.7 141.13 31.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.547 -172.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.615 HD12 ' HA ' ' A' ' 118' ' ' THR . 64.5 mt -77.66 135.29 26.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.205 178.369 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -84.39 -48.22 9.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.104 0.478 . . . . 0.0 110.759 -178.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -141.66 116.6 9.88 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.523 -176.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.801 HG21 ' HD2' ' A' ' 120' ' ' PRO . 9.0 m -89.65 163.83 2.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 21.0 mtm -125.26 18.19 8.31 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.594 0.235 . . . . 0.0 110.791 -174.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.401 ' C ' ' H ' ' A' ' 15' ' ' THR . 90.6 mt-30 69.18 -60.21 0.46 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.168 -176.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -79.23 24.33 0.34 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.705 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.401 ' H ' ' C ' ' A' ' 13' ' ' GLN . 11.8 m -83.13 103.25 12.4 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.311 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.556 HG12 ' HB3' ' A' ' 122' ' ' LYS . 28.4 mt -100.88 108.73 23.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 175.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -92.35 111.6 24.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.413 -174.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.63 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 16.8 m120 -99.61 116.46 31.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.076 -178.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.455 ' O ' ' HG3' ' A' ' 125' ' ' GLU . 28.8 p90 -112.36 174.44 5.88 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.238 178.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -142.16 100.57 3.75 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.7 p 49.17 -144.39 0.46 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 123.778 0.674 . . . . 0.0 110.967 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.67 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 17.0 p -76.01 -77.16 0.14 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.45 -179.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.8 m 68.16 -61.09 0.4 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.107 0.563 . . . . 0.0 112.163 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.406 ' CG ' ' H ' ' A' ' 25' ' ' ASP . 9.5 t70 -132.04 -164.7 1.49 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -175.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.406 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 28.3 t70 -71.25 -20.05 62.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.458 0.647 . . . . 0.0 110.242 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -77.77 -5.66 51.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.505 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.67 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -71.28 -0.85 39.32 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.892 -0.595 . . . . 0.0 114.026 -174.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.41 -24.48 60.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.011 0.434 . . . . 0.0 111.658 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.401 ' HD2' HD23 ' A' ' 149' ' ' LEU . 69.8 m-85 -66.1 -13.3 59.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.431 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.2 t -86.56 131.78 34.08 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 174.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -75.5 8.7 2.64 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -176.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -98.52 4.2 48.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.366 0.603 . . . . 0.0 109.636 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.402 ' O ' HG22 ' A' ' 46' ' ' THR . . . -71.14 138.0 49.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.474 177.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.428 ' HA ' ' CG2' ' A' ' 46' ' ' THR . . . -86.35 60.65 6.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.18 0.514 . . . . 0.0 111.613 -173.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -101.95 113.05 65.97 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.12 175.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.84 132.83 44.41 Favored 'Trans proline' 0 C--O 1.239 0.531 0 C-N-CA 122.776 2.318 . . . . 0.0 112.35 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.511 HG13 ' HB2' ' A' ' 44' ' ' TRP . 12.4 pt -126.11 130.34 72.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.523 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -86.78 98.68 11.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.417 177.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.0 t -126.16 129.13 72.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.97 -174.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 59.68 20.63 9.31 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.812 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 108.46 -14.26 35.89 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.584 -0.817 . . . . 0.0 113.551 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.407 ' HD2' ' HA ' ' A' ' 42' ' ' LYS . 12.6 tptm -124.79 161.84 25.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 117.938 0.869 . . . . 0.0 110.922 -172.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.5 m -96.71 115.44 27.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.898 0.38 . . . . 0.0 110.604 -177.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.511 ' HB2' HG13 ' A' ' 37' ' ' ILE . 67.4 m95 -96.65 129.33 33.25 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.688 178.211 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 27.3 Cg_exo -64.43 -25.61 63.34 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 123.185 2.59 . . . . 0.0 113.082 -176.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.428 ' CG2' ' HA ' ' A' ' 34' ' ' ALA . 0.9 OUTLIER -155.38 162.05 40.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.092 -178.566 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.2 m -66.15 -36.93 84.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.591 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -23.1 62.62 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -175.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -62.94 -45.14 93.88 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.88 0.371 . . . . 0.0 110.461 175.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -70.1 -41.99 73.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.509 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -59.61 -44.31 93.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.662 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.647 ' HG3' ' HA3' ' A' ' 78' ' ' GLY . 0.0 OUTLIER -69.53 -36.16 76.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.691 0.282 . . . . 0.0 110.95 -179.857 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.424 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -70.17 -39.06 75.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.925 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -81.53 -18.93 43.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.871 0.367 . . . . 0.0 110.733 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -59.7 -31.63 69.77 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.027 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.448 ' CE1' ' HA2' ' A' ' 78' ' ' GLY . 88.8 m-85 -95.71 132.38 40.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.772 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 84' ' ' PRO . 0.5 OUTLIER -88.93 0.85 56.25 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.443 0.64 . . . . 0.0 109.681 170.639 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -84.96 111.04 19.33 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 170.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.575 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 40.5 mt-10 -77.31 -10.87 59.7 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.714 -172.1 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -73.57 -45.01 55.89 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -66.21 -38.26 87.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.58 172.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.424 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.2 ttp180 -61.03 -38.41 86.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.653 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.575 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 48.9 mm-40 -60.72 -48.15 83.08 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.386 174.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.18 -49.56 76.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.835 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 74.7 mt -64.15 -27.8 43.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.556 -176.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 66' ' ' ARG . 41.3 ttp-105 -77.11 -23.73 51.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.735 0.303 . . . . 0.0 111.259 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 23.8 mtm180 -93.71 -14.64 26.1 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -174.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.0 m -85.75 131.44 34.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.246 0.546 . . . . 0.0 111.069 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.1 t -87.97 -7.11 57.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.751 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.447 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.5 m -87.59 116.05 64.86 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.252 -177.078 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 16.9 Cg_exo -69.03 -51.41 0.45 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.037 2.492 . . . . 0.0 112.551 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 86.2 mtp -63.02 -38.62 91.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 111.044 -175.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 61.1 t -64.59 -39.07 84.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.486 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -51.05 55.17 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.643 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -57.91 -39.77 78.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.56 -178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -65.71 -53.72 37.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.68 0.276 . . . . 0.0 111.234 -177.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -76.14 -18.96 58.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.937 0.399 . . . . 0.0 110.699 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.647 ' HA3' ' HG3' ' A' ' 52' ' ' GLN . . . -83.22 -21.58 58.54 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.753 -0.737 . . . . 0.0 111.98 178.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.6 ttm105 -73.35 -9.22 58.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.149 0.5 . . . . 0.0 110.437 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.623 ' OD1' ' HG2' ' A' ' 83' ' ' LYS . 10.2 t70 -51.92 131.95 31.64 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.154 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.597 ' HD3' ' O ' ' A' ' 81' ' ' ARG . 4.5 tmt_? -112.46 -7.42 13.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.184 0.516 . . . . 0.0 110.073 -177.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.2 m -79.87 -19.02 49.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.189 0.518 . . . . 0.0 110.272 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.623 ' HG2' ' OD1' ' A' ' 80' ' ' ASP . 42.5 mmtm -75.1 161.94 75.26 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.375 176.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.537 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 32.0 Cg_endo -64.36 115.21 3.04 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.231 1.954 . . . . 0.0 111.991 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.426 HD11 ' HG2' ' A' ' 81' ' ' ARG . 96.0 mt -90.0 166.96 13.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.021 178.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -86.0 142.81 28.5 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -178.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -58.54 -48.5 80.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.397 . . . . 0.0 110.834 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -96.44 32.87 1.9 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.985 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.5 ' O ' ' HB2' ' A' ' 93' ' ' LYS . 19.2 t-105 -55.67 -44.08 76.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.028 -178.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.16 -18.94 64.0 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.007 0.432 . . . . 0.0 111.33 -177.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.0 m -90.14 -43.37 10.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.666 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.406 ' O ' HG23 ' A' ' 96' ' ' VAL . 33.2 m -79.16 -17.25 13.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.621 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.5 ' HB2' ' O ' ' A' ' 89' ' ' TRP . 21.4 tttp -50.49 -50.16 53.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.458 0.647 . . . . 0.0 110.279 176.038 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.464 ' H ' ' HG2' ' A' ' 94' ' ' GLU . 3.4 mm-40 -63.28 -38.23 90.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.676 -178.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -79.74 -42.2 25.08 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.515 -173.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 92' ' ' VAL . 94.7 t -61.62 -41.76 91.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.871 0.367 . . . . 0.0 110.115 177.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 49.0 tpp -62.44 -45.48 92.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.397 177.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 98' ' ' ARG . 17.2 ttm180 -63.85 -38.13 89.96 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.8 178.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -61.79 -44.99 95.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.76 0.314 . . . . 0.0 110.395 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.79 -44.98 79.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.723 177.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.403 HD13 HD12 ' A' ' 149' ' ' LEU . 75.7 mt -59.52 -49.54 77.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.194 178.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -59.77 -48.56 81.2 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.557 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.88 -39.07 73.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.958 0.409 . . . . 0.0 110.629 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.81 -46.4 58.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.253 -175.206 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -82.02 -38.53 24.89 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -76.97 -33.93 57.61 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 122.086 -0.384 . . . . 0.0 111.577 -173.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -83.83 -2.8 57.12 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.141 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.407 ' HB3' ' HG ' ' A' ' 111' ' ' LEU . 65.7 m-70 -126.4 100.25 6.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.463 177.105 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.4 -32.0 66.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.89 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.466 ' HB3' HG21 ' A' ' 3' ' ' VAL . 1.4 mp0 -56.64 -50.6 71.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.089 177.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.407 ' HG ' ' HB3' ' A' ' 108' ' ' HIS . 22.3 mt -76.73 -31.47 57.16 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.509 -173.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -59.15 -44.41 92.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.959 175.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.97 -46.85 89.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.655 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 56.5 tp -59.19 -47.81 83.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.848 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.433 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 48.9 tp -62.47 -50.58 70.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.479 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.539 HD11 ' HB2' ' A' ' 156' ' ' LEU . 10.6 mp -70.95 -13.33 61.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.918 -175.464 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.83 -22.78 60.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.762 -0.199 . . . . 0.0 111.241 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.615 ' HA ' HD12 ' A' ' 8' ' ' ILE . 47.5 p -78.72 -29.99 45.66 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.561 -177.3 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.497 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -51.29 136.57 30.46 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.801 ' HD2' HG21 ' A' ' 11' ' ' VAL . 85.4 Cg_endo -101.39 42.57 3.19 Favored 'Cis proline' 0 CA--C 1.537 0.642 0 C-N-CA 124.757 -0.934 . . . . 0.0 113.152 -3.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.98 159.11 34.37 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 122.167 -0.333 . . . . 0.0 110.973 178.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.556 ' HB3' HG12 ' A' ' 16' ' ' ILE . 35.5 ttmt -89.49 121.09 31.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.836 0.35 . . . . 0.0 110.487 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.404 HD12 ' HB3' ' A' ' 149' ' ' LEU . 70.1 mt -89.67 108.82 19.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.718 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.63 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 96.1 t -137.91 117.31 14.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.523 -179.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 19' ' ' PHE . 44.9 tt0 -89.4 110.62 21.41 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 173.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.484 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 86.1 t60 -82.44 77.33 9.23 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 98.8 m -92.05 99.14 12.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 174.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.457 ' HG3' ' HA3' ' A' ' 137' ' ' GLY . 19.7 tt0 -79.37 -15.94 57.07 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.139 -171.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.409 ' O ' ' HB2' ' A' ' 130' ' ' ASP . 91.3 m-20 -101.68 112.27 24.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.329 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 129' ' ' ASN . 23.8 m-20 72.84 110.19 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.119 0.887 . . . . 0.0 111.392 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.448 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -86.42 94.15 9.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.83 -179.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -159.73 111.08 2.0 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 51.5 m95 70.08 8.13 6.53 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.392 0.677 . . . . 0.0 111.322 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -125.61 -160.48 10.68 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.484 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 0.8 OUTLIER -89.89 -14.08 35.01 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 118.257 1.028 . . . . 0.0 109.768 177.425 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 69.22 17.52 72.21 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.21 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.468 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 90.11 9.33 65.69 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 121.048 -0.596 . . . . 0.0 113.514 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -160.98 -37.75 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 117.593 0.696 . . . . 0.0 112.716 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 147.78 -48.54 0.63 Allowed Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.716 -179.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -76.11 58.68 1.24 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.58 0.705 . . . . 0.0 110.403 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.448 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -125.51 15.23 7.18 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 174.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.442 ' C ' ' H ' ' A' ' 144' ' ' ARG . 55.4 mttm 68.99 55.92 0.42 Allowed 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.732 -0.734 . . . . 0.0 111.411 -174.362 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -68.91 4.9 1.29 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.544 0.688 . . . . 0.0 109.747 173.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 0.0 OUTLIER -52.89 -17.3 1.33 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.174 176.156 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 55.7 tp -58.56 -58.34 8.97 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 169.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.622 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -59.77 -30.7 69.8 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.831 175.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -67.07 -40.8 87.09 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 177.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 89.0 mt -67.87 -33.92 75.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.901 0.381 . . . . 0.0 110.228 176.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.404 ' HB3' HD12 ' A' ' 123' ' ' LEU . 8.2 mp -59.62 -41.65 90.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.839 172.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.622 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 53.7 mtt -61.55 -52.0 66.27 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 175.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -47.69 -54.27 12.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.332 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 56.7 tp -68.93 -39.98 79.28 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.211 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.433 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 59.8 ttp180 -58.3 -50.31 74.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.814 -177.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.617 ' HG2' ' O ' ' A' ' 150' ' ' MET . 14.7 mm-40 -59.98 -46.41 89.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.132 0.491 . . . . 0.0 110.177 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -59.53 -41.33 89.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.705 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.539 ' HB2' HD11 ' A' ' 116' ' ' LEU . 87.3 mt -77.17 -31.54 55.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.788 0.328 . . . . 0.0 110.846 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -64.27 -44.71 90.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.138 -179.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 154' ' ' GLU . 83.9 mt -57.25 -40.46 73.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.282 -179.019 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -80.14 -7.94 59.17 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.424 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -82.82 -26.93 31.25 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.27 -16.65 63.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.881 172.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.414 ' C ' ' H ' ' A' ' 164' ' ' HIS . 8.9 mm-40 -83.42 11.28 7.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.572 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -76.36 22.29 0.17 Allowed 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.898 0.38 . . . . 0.0 111.294 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' HIS . . . . . 0.414 ' H ' ' C ' ' A' ' 162' ' ' GLU . 65.7 t60 -72.09 97.12 1.86 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.192 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -140.45 114.17 8.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.148 174.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 70.3 t60 -141.43 -3.22 1.19 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.033 0.444 . . . . 0.0 110.649 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -122.07 132.04 54.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.598 -0.274 . . . . 0.0 110.865 178.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 7.9 p80 . . . . . 0 C--O 1.243 0.747 0 CA-C-O 118.6 -0.714 . . . . 0.0 109.82 179.551 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.426 ' HA ' ' OD1' ' A' ' 25' ' ' ASP . 27.4 ttt . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.774 0.321 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.425 ' HD3' ' N ' ' A' ' 1' ' ' MET . 11.5 Cg_endo -89.75 107.02 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 123.005 2.47 . . . . 0.0 111.257 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.4 t -83.55 63.24 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-O 121.32 0.581 . . . . 0.0 110.544 -174.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.498 ' HD3' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -77.24 81.47 3.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.584 176.13 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.595 ' HA ' HD13 ' A' ' 114' ' ' LEU . . . -60.45 -56.1 25.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.56 -178.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -83.93 82.7 8.23 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.295 0.569 . . . . 0.0 110.943 -177.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.517 ' HG3' HG13 ' A' ' 8' ' ' ILE . 1.8 ptm180 -123.07 -27.02 4.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.712 178.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.517 HG13 ' HG3' ' A' ' 7' ' ' ARG . 60.5 mt -99.78 119.07 47.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 178.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -59.37 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.174 0.512 . . . . 0.0 109.88 -177.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.412 ' C ' ' H ' ' A' ' 12' ' ' MET . 2.1 m80 -124.78 130.73 52.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.876 174.412 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.7 m -74.97 10.6 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.884 174.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.465 ' HB2' ' OG1' ' A' ' 15' ' ' THR . 57.3 mtm 69.09 -160.59 0.18 Allowed 'General case' 0 C--O 1.232 0.157 0 O-C-N 123.858 0.724 . . . . 0.0 109.9 -179.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -127.72 141.91 51.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -177.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 59.82 27.73 17.09 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.339 0.59 . . . . 0.0 110.713 -177.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.465 ' OG1' ' HB2' ' A' ' 12' ' ' MET . 96.8 m -92.7 124.09 36.46 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.168 -177.065 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mp -100.03 116.42 43.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.431 176.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 61.2 mt -89.86 96.73 6.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.416 0.627 . . . . 0.0 109.458 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -101.04 130.1 47.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.003 -177.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.0 p90 -132.1 177.33 7.65 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.091 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.51 103.99 5.02 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.419 177.271 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.1 m 63.02 -155.5 0.33 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.153 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.657 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 17.4 p -74.13 -16.0 61.02 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -177.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 m 47.67 -94.99 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 O-C-N 123.809 0.693 . . . . 0.0 111.34 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -162.46 115.27 1.69 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.581 174.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.426 ' OD1' ' HA ' ' A' ' 1' ' ' MET . 22.1 t70 68.48 -68.95 0.16 Allowed 'General case' 0 N--CA 1.47 0.565 0 O-C-N 124.069 0.855 . . . . 0.0 112.321 174.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -78.37 -1.43 33.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.528 0.68 . . . . 0.0 111.087 -175.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.657 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -74.36 -0.24 56.91 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.361 175.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -46.27 -28.45 1.29 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.05 0.94 . . . . 0.0 112.955 -176.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -53.58 -38.69 64.16 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.583 0.23 . . . . 0.0 111.584 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 10.9 t -61.82 143.89 55.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.197 0.522 . . . . 0.0 110.819 -176.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -65.26 -31.57 72.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.001 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -77.51 9.99 2.92 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.303 0.573 . . . . 0.0 110.924 -176.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.78 142.56 46.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.661 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.55 62.23 4.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.592 0.71 . . . . 0.0 111.103 -175.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.447 ' CZ2' HD21 ' A' ' 111' ' ' LEU . 86.3 m95 -105.75 102.49 38.82 Favored Pre-proline 0 C--N 1.315 -0.895 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.041 173.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -56.91 131.0 42.83 Favored 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 122.903 2.402 . . . . 0.0 112.117 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.518 HG13 ' HB2' ' A' ' 44' ' ' TRP . 18.3 pt -122.32 126.33 74.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.501 0.667 . . . . 0.0 111.248 -178.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -88.17 103.24 15.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 175.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.402 ' HB ' ' CD1' ' A' ' 44' ' ' TRP . 21.8 t -127.43 125.32 65.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.826 -174.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 62.42 23.72 14.08 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.787 0.679 . . . . 0.0 111.209 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.61 13.25 76.23 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.31 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.667 ' HD2' ' HD3' ' A' ' 66' ' ' ARG . 71.7 mmtt -117.46 154.62 31.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 m -105.19 106.28 16.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.828 0.347 . . . . 0.0 110.462 179.373 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.518 ' HB2' HG13 ' A' ' 37' ' ' ILE . 32.8 m95 -105.13 121.46 46.35 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -59.11 -34.5 98.73 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.735 2.29 . . . . 0.0 112.768 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.8 p -146.4 165.38 29.52 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -179.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.85 -28.99 69.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.793 0.33 . . . . 0.0 111.438 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 7.6 mp0 -64.78 -28.55 69.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.632 -178.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.403 ' HB3' ' HE3' ' A' ' 44' ' ' TRP . 36.3 m80 -64.7 -47.06 79.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.471 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -70.87 -35.72 72.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.388 0.613 . . . . 0.0 109.608 177.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -58.51 -41.77 86.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.834 177.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.662 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 68.3 mm-40 -74.37 -46.65 39.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.414 178.029 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.93 -38.63 76.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.986 -176.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -84.14 -24.5 30.21 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.542 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.661 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.1 ttmp? -60.01 -42.6 94.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.154 0.502 . . . . 0.0 110.242 172.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.433 ' HD1' ' O ' ' A' ' 52' ' ' GLN . 21.8 m-85 -77.37 135.07 38.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.327 178.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.753 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.4 pt? -97.63 12.79 32.39 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.339 0.59 . . . . 0.0 109.484 175.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -98.5 128.52 44.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.91 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -69.94 -35.35 74.46 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -175.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -67.76 -36.92 81.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.849 0.357 . . . . 0.0 110.33 -178.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.406 ' O ' HG13 ' A' ' 65' ' ' ILE . 6.9 m-85 -77.79 -28.18 50.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.944 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 54.6 ttp85 -59.06 -51.8 68.49 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.036 0.446 . . . . 0.0 110.208 175.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -75.57 -19.38 59.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -69.12 -46.31 67.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.211 0.529 . . . . 0.0 110.184 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.608 HG21 ' HB2' ' A' ' 52' ' ' GLN . 68.7 mt -72.95 -19.63 18.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.396 0.617 . . . . 0.0 110.12 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.667 ' HD3' ' HD2' ' A' ' 42' ' ' LYS . 12.6 ttp180 -72.72 -28.17 62.5 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.324 170.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -78.36 -41.97 31.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.253 -176.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.504 HG21 ' HB ' ' A' ' 73' ' ' VAL . 8.4 p -65.28 121.38 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.562 0.696 . . . . 0.0 111.672 -175.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.8 m -77.32 -42.28 37.36 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.422 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.401 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 47.4 t -70.59 127.42 91.98 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.239 -176.008 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 19.7 Cg_exo -66.61 -30.69 42.25 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.799 2.333 . . . . 0.0 111.924 176.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.2 mmt -70.19 -37.88 75.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.134 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.504 ' HB ' HG21 ' A' ' 68' ' ' VAL . 47.4 t -71.99 -32.22 43.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.091 0.472 . . . . 0.0 110.078 177.342 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.09 -39.84 93.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.22 173.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.88 -34.72 79.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.05 175.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -61.5 -33.15 73.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.122 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 25.6 mmt -61.77 -50.84 70.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.563 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.14 -26.05 62.74 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.833 -178.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 79' ' ' ARG . 2.6 tpt180 -84.47 -0.22 52.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.932 0.396 . . . . 0.0 110.326 -178.413 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.02 -31.45 71.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.022 -177.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 75.6 -46.24 0.56 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.95 175.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.5 m -82.59 40.17 0.65 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.306 0.574 . . . . 0.0 111.189 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.407 ' HB3' ' CE2' ' A' ' 56' ' ' PHE . 44.8 mmtm -123.24 151.67 62.65 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.139 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.35 105.17 1.68 Allowed 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.286 1.991 . . . . 0.0 112.909 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.42 HD22 ' HD3' ' A' ' 55' ' ' LYS . 54.2 mt -86.8 145.32 26.66 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 174.146 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.588 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . 8.0 ptp180 -74.17 164.53 26.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.245 0.545 . . . . 0.0 111.934 -175.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tptt -67.68 -40.75 84.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.708 -172.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.415 ' O ' HG22 ' A' ' 92' ' ' VAL . 10.3 m120 -101.34 23.48 10.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.429 -172.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.402 ' CZ2' ' HE3' ' A' ' 55' ' ' LYS . 38.7 t-105 -58.69 -47.1 85.68 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -175.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -59.35 -29.21 67.5 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -175.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.4 p -90.29 -22.6 21.5 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -176.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 88' ' ' ASN . 31.1 m -108.24 -5.92 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -176.095 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -49.11 -53.64 19.75 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.095 0.474 . . . . 0.0 111.614 -178.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -71.02 -29.98 66.05 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.52 -178.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -71.35 -42.39 68.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.934 -178.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 79.6 t -60.41 -46.62 94.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.104 0.478 . . . . 0.0 110.218 176.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.439 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 52.6 ttm -64.85 -42.21 95.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.756 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -65.8 -33.5 76.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.731 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.42 -45.12 77.05 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.03 0.443 . . . . 0.0 110.154 175.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.45 98.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.607 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 97' ' ' MET . 95.0 mt -66.04 -32.59 74.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.85 177.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.569 ' HG2' HD11 ' A' ' 152' ' ' LEU . 1.9 tmm_? -64.88 -44.26 90.22 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -69.06 -32.66 72.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.031 0.443 . . . . 0.0 110.669 176.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -63.71 -47.98 78.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.106 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.426 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 56.8 m-85 -85.6 -43.3 13.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.1 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -69.36 -43.71 73.02 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.538 -174.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 99.4 mt-30 -80.1 -1.36 39.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.899 0.38 . . . . 0.0 111.44 -175.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -122.95 96.42 5.01 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 170.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -53.74 -38.19 64.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.945 -171.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -57.74 -45.8 85.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 178.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.447 HD21 ' CZ2' ' A' ' 35' ' ' TRP . 34.6 mt -68.72 -42.45 77.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.249 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.604 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 49.4 ttp85 -59.53 -45.21 92.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.551 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.57 -42.49 98.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.709 178.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.595 HD13 ' HA ' ' A' ' 5' ' ' ALA . 50.3 tp -61.71 -48.87 78.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.619 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 153' ' ' ARG . 47.8 tp -56.93 -43.56 81.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.906 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.855 HD23 ' HG2' ' A' ' 153' ' ' ARG . 47.9 mt -68.7 -35.04 76.67 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.168 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.15 -15.1 60.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -176.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 33.7 p -82.06 -21.42 36.88 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 120.199 -0.601 . . . . 0.0 111.913 -176.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.52 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -64.01 148.18 95.5 Favored Pre-proline 0 C--O 1.234 0.247 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.492 174.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -94.5 32.67 10.68 Favored 'Cis proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.906 -1.289 . . . . 0.0 113.544 1.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.31 140.91 48.81 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 176.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -85.79 119.93 26.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.539 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 40.6 mt -80.15 122.78 27.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.499 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 80.4 t -132.48 114.67 23.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.189 0.519 . . . . 0.0 112.123 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -77.99 115.77 17.98 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 167.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.566 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 59.9 t60 -87.8 77.23 8.62 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.739 -173.1 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.606 ' OG1' ' HA3' ' A' ' 134' ' ' GLY . 1.0 OUTLIER -77.33 96.75 4.69 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.779 -179.588 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -93.86 -16.03 24.47 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.796 -175.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -66.97 -43.92 81.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.493 176.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -163.25 152.96 15.32 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -178.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.19 85.64 5.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.405 0.621 . . . . 0.0 110.044 178.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.508 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 37.5 t80 -149.32 106.21 3.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.566 -176.195 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.612 ' H ' ' HB3' ' A' ' 142' ' ' LYS . 66.9 m95 65.74 10.06 6.49 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.652 -176.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.606 ' HA3' ' OG1' ' A' ' 127' ' ' THR . . . -131.26 -161.12 10.12 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.57 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.566 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 4.0 p-10 -91.42 -6.58 52.57 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.754 0.311 . . . . 0.0 111.301 -176.009 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 76.35 7.11 84.83 Favored Glycine 0 N--CA 1.454 -0.155 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.037 177.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.447 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 82.04 40.05 10.87 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.938 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -179.35 -25.91 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.343 0.257 . . . . 0.0 111.6 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLY . . . . . 0.438 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 132.37 -16.31 4.9 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 119.881 -1.152 . . . . 0.0 113.776 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -133.39 82.11 1.97 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 117.315 0.558 . . . . 0.0 110.459 -177.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.39 -60.91 0.19 Allowed Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.246 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.612 ' HB3' ' H ' ' A' ' 133' ' ' TRP . 1.7 ttmp? -175.48 48.87 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -65.76 5.11 0.5 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.003 -0.998 . . . . 0.0 112.735 -171.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.544 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 30.8 ttm180 -54.84 -22.45 14.58 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.405 ' HB2' ' HB3' ' A' ' 133' ' ' TRP . 66.5 tp -61.48 -59.03 5.87 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.715 0.293 . . . . 0.0 110.345 174.458 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.428 ' HA2' HD12 ' A' ' 149' ' ' LEU . . . -61.95 -31.58 79.02 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.567 176.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' TYR . . . . . 0.441 ' HB3' ' HA ' ' A' ' 144' ' ' ARG . 56.8 t80 -61.68 -43.91 97.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.529 -0.336 . . . . 0.0 110.137 176.369 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 94.0 mt -66.9 -36.37 82.14 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.76 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.428 HD12 ' HA2' ' A' ' 146' ' ' GLY . 97.5 mt -60.76 -44.65 96.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.554 177.534 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 73.2 mtm -74.26 -34.59 63.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.875 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.04 -49.63 77.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.486 0.66 . . . . 0.0 109.619 175.166 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.569 HD11 ' HG2' ' A' ' 102' ' ' ARG . 55.5 tp -65.5 -34.63 78.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.076 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.855 ' HG2' HD23 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -59.12 -40.09 84.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.449 -179.362 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.449 ' O ' HG13 ' A' ' 158' ' ' ILE . 13.7 mm-40 -64.71 -39.04 92.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.501 177.041 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -64.5 -43.67 93.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.088 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.531 ' HB2' HD21 ' A' ' 116' ' ' LEU . 89.1 mt -69.84 -31.13 68.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.888 0.375 . . . . 0.0 110.496 -177.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.88 -36.29 81.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.353 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 154' ' ' GLU . 97.4 mt -68.3 -42.72 84.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.62 178.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.71 -37.8 85.44 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.023 177.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -64.4 -35.54 81.25 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 7.2 tp -64.53 -29.52 70.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.379 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -78.92 11.15 2.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.78 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 15.6 p-80 -60.7 108.04 0.78 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.511 0.672 . . . . 0.0 109.884 175.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -130.84 175.33 9.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.911 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -74.16 86.05 1.88 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.092 0.472 . . . . 0.0 110.588 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 7.4 t-80 -109.33 125.89 52.81 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -51.95 22.66 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.994 -173.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 20.9 m170 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.717 -0.659 . . . . 0.0 109.748 174.238 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.61 127.75 12.76 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.755 2.304 . . . . 0.0 112.635 -177.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 51.4 t -80.79 89.25 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -87.76 81.63 7.56 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.564 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.25 34.86 0.57 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.527 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -156.87 86.27 0.98 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.882 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 26' ' ' TYR . 16.0 mmt180 -114.93 -51.37 2.74 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 171.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.0 mt -106.9 104.41 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.422 177.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -99.51 -31.05 11.82 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.638 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -110.5 109.79 20.27 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.221 -178.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.1 m -85.98 159.01 3.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.979 0.419 . . . . 0.0 110.317 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.1 mtm -93.14 18.75 8.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.929 -176.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 65.78 115.8 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.311 -178.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.8 t70 52.48 66.54 1.19 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.608 0.718 . . . . 0.0 110.802 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -117.15 150.52 38.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.687 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.506 HG13 ' HD2' ' A' ' 122' ' ' LYS . 3.5 mp -98.73 107.58 20.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 120.973 0.416 . . . . 0.0 110.089 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.2 mt -90.78 111.05 23.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.946 0.403 . . . . 0.0 110.711 -178.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.463 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 4.6 m-20 -90.79 104.44 17.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.774 176.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -100.76 137.28 39.35 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.774 0.321 . . . . 0.0 110.458 -178.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.431 ' O ' ' HB3' ' A' ' 21' ' ' SER . 5.1 t80 -150.54 169.9 20.42 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.876 175.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.445 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 39.9 t 75.64 109.28 0.07 Allowed 'General case' 0 C--O 1.231 0.099 0 O-C-N 123.924 0.765 . . . . 0.0 111.721 175.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 p -81.17 2.54 27.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.388 176.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -91.57 -4.68 55.1 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.223 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -107.88 165.87 11.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.722 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -77.1 -15.11 59.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.923 -175.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.443 ' CZ ' ' HB2' ' A' ' 7' ' ' ARG . 1.4 m-85 -101.22 -1.55 33.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.916 0.389 . . . . 0.0 111.07 176.49 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' A' ' 21' ' ' SER . . . -75.74 0.16 62.22 Favored Glycine 0 C--O 1.229 -0.214 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.906 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -57.51 -32.95 67.54 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -63.14 -21.35 66.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.596 -177.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 75.7 m -68.05 144.26 55.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.254 0.549 . . . . 0.0 111.052 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -67.78 -20.2 65.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.86 -176.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -95.06 10.89 34.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.941 0.401 . . . . 0.0 110.9 -177.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.43 140.17 58.09 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.85 0.357 . . . . 0.0 111.286 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.531 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -86.08 59.43 5.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.94 -177.428 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 50.3 m95 -118.9 116.09 34.55 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.729 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 28.4 Cg_exo -61.59 128.16 23.84 Favored 'Trans proline' 0 C--O 1.238 0.52 0 C-N-CA 123.098 2.532 . . . . 0.0 112.413 -178.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.528 HG22 ' HA ' ' A' ' 104' ' ' LYS . 16.4 pt -112.31 133.7 57.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.891 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -93.95 105.07 17.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.693 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.2 t -123.88 118.94 55.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.996 -175.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 58.62 27.86 16.34 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.631 0.582 . . . . 0.0 111.428 176.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.44 -7.96 66.38 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.131 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -114.67 135.68 53.89 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 122.209 -0.583 . . . . 0.0 110.802 -177.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.5 m -95.4 106.44 18.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.92 -175.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 65.6 m95 -91.38 128.83 45.41 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.795 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.44 -35.55 85.28 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.087 2.524 . . . . 0.0 113.412 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.531 HG22 ' HA ' ' A' ' 34' ' ' ALA . 65.4 p -148.84 165.25 32.06 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 9.3 m -56.83 -41.56 78.09 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.285 0.366 . . . . 0.0 110.703 177.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.787 ' O ' ' HB2' ' A' ' 52' ' ' GLN . 10.0 tp10 -73.65 -1.13 17.68 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.735 -177.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.428 ' NE2' HG13 ' A' ' 68' ' ' VAL . 18.1 m80 -85.03 -40.61 16.65 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 120.984 -1.073 . . . . 0.0 109.47 171.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -74.16 -35.97 64.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.274 0.559 . . . . 0.0 109.573 174.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.558 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 37.8 t80 -72.03 -31.29 66.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.495 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.787 ' HB2' ' O ' ' A' ' 48' ' ' GLU . 3.8 tp-100 -71.73 -45.74 60.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.297 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.92 -37.31 84.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.146 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -88.42 -8.23 55.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.348 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.618 ' HG3' ' CZ2' ' A' ' 89' ' ' TRP . 4.9 ttmp? -69.46 -30.48 68.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.329 0.585 . . . . 0.0 109.936 175.143 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.49 ' CE2' ' HA2' ' A' ' 78' ' ' GLY . 91.3 m-85 -116.4 175.88 5.36 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.291 -178.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.28 7.23 9.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.792 178.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.781 ' HB2' ' HB2' ' A' ' 61' ' ' TYR . 27.9 m-20 -76.0 126.45 31.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.823 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.452 ' HG3' ' H ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -64.02 -36.52 84.26 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.49 175.942 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 64' ' ' GLU . 35.9 mmtm -65.18 -48.29 73.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.567 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.781 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -63.02 -45.75 90.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.154 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -54.74 -42.79 72.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.66 178.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.546 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 27.5 mt-10 -69.48 -40.64 76.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.355 178.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 6.0 mm-40 -63.77 -44.44 93.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.832 0.348 . . . . 0.0 111.319 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.664 HG21 ' HB3' ' A' ' 52' ' ' GLN . 74.7 mt -67.27 -26.13 35.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.358 0.599 . . . . 0.0 110.675 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 66' ' ' ARG . 0.0 OUTLIER -77.15 -14.99 59.7 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.92 174.984 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 84.8 mtp180 -96.15 -4.64 42.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.378 -178.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.428 HG13 ' NE2' ' A' ' 49' ' ' HIS . 10.0 p -110.35 132.54 58.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.047 0.451 . . . . 0.0 111.651 -174.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -93.66 -36.83 12.15 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.438 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 2.5 m -63.13 117.17 30.63 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.993 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 21.8 Cg_exo -65.36 -42.06 14.13 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.854 2.369 . . . . 0.0 112.79 -176.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.4 tpt -65.0 -36.15 83.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.098 -175.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 98.4 t -63.97 -44.01 97.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-O 120.928 0.394 . . . . 0.0 110.357 178.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.84 98.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.484 178.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.411 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -61.53 -41.64 97.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.05 178.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.64 -48.3 82.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.282 -179.412 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.6 ptp -71.61 -22.77 61.67 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.821 -178.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.49 ' HA2' ' CE2' ' A' ' 56' ' ' PHE . . . -77.88 -20.19 73.91 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.634 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.3 mtp85 -86.47 38.73 0.8 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.034 0.445 . . . . 0.0 111.396 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -111.05 109.6 19.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.5 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 81' ' ' ARG . 7.2 tpt180 -90.92 0.79 57.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.499 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.9 m -66.74 -37.84 85.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.035 -176.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.448 ' HD2' ' CE1' ' A' ' 56' ' ' PHE . 9.3 ptpp? -85.26 155.04 60.36 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.796 -178.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.63 117.74 5.26 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.329 2.019 . . . . 0.0 112.123 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.12 174.88 7.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.062 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.66 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 63.1 mtp180 -71.09 143.03 50.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.611 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -47.71 -44.6 27.79 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.174 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -118.01 27.03 9.25 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.474 -175.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.66 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 29.5 t-105 -58.69 -43.4 89.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.97 -15.86 60.22 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.11 -178.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 8.0 m -98.73 -48.89 4.78 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.903 0.382 . . . . 0.0 111.191 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.448 ' O ' HG23 ' A' ' 96' ' ' VAL . 33.4 m -76.69 -8.69 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.478 -176.132 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.462 ' HG2' ' HZ2' ' A' ' 133' ' ' TRP . 35.9 ttmt -48.63 -53.98 16.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.743 -179.105 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -69.88 -23.42 63.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.224 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -76.27 -42.92 43.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.962 0.411 . . . . 0.0 110.24 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 92' ' ' VAL . 87.7 t -60.56 -49.84 82.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.029 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 48.6 ttm -69.4 -33.19 72.64 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.991 -178.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 98' ' ' ARG . 14.2 ttm-85 -62.39 -41.65 98.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.769 0.319 . . . . 0.0 110.167 178.538 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -68.09 -39.31 82.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.617 178.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.64 -46.46 89.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.571 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 96.3 mt -63.9 -39.34 93.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.721 177.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 102' ' ' ARG . 21.5 ttt180 -58.62 -46.99 85.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.04 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.73 -33.16 73.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.884 178.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.528 ' HA ' HG22 ' A' ' 37' ' ' ILE . 61.2 tttp -56.28 -59.35 5.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.268 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.535 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 89.3 m-85 -82.49 -9.69 59.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.167 -176.356 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -87.95 -35.4 17.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.958 0.408 . . . . 0.0 110.721 177.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -77.17 -47.68 19.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.384 -177.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -92.88 108.44 20.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.705 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.16 -29.76 70.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.122 176.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.418 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.4 mp0 -55.94 -48.2 76.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.88 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 47.9 mt -74.51 -36.62 63.21 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.433 -176.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.535 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 25.5 ttm180 -59.53 -45.09 92.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.633 176.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.82 -39.41 94.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.587 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 tp -66.17 -44.36 84.27 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.551 177.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.417 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 53.6 tp -60.39 -51.94 67.35 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.302 179.369 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.456 HD21 ' HA ' ' A' ' 157' ' ' ALA . 11.0 mp -67.09 -23.09 65.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.595 -177.181 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -68.43 -22.6 64.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.596 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 44.9 p -71.08 -35.96 72.07 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 116.73 -0.213 . . . . 0.0 111.078 -178.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -49.31 135.86 16.44 Favored Pre-proline 0 N--CA 1.464 0.249 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.47 -179.262 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.5 Cg_endo -99.55 48.31 1.99 Allowed 'Cis proline' 0 CA--C 1.536 0.604 0 C-N-CA 124.184 -1.173 . . . . 0.0 113.495 0.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -88.5 160.32 17.55 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.811 0.338 . . . . 0.0 111.497 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.506 ' HD2' HG13 ' A' ' 16' ' ' ILE . 46.4 mttp -86.18 146.34 26.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.939 178.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.8 mt -108.53 112.71 25.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.144 177.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 98.6 t -128.97 124.5 61.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.875 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -86.84 117.34 25.51 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.415 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 7.1 t60 -98.24 80.1 2.63 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.427 -170.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.2 t -103.15 162.19 13.17 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 171.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -138.92 15.24 2.67 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.818 0.818 . . . . 0.0 109.81 177.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -81.77 -26.23 34.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.124 173.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -173.95 -174.15 0.9 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.607 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.46 ' HB1' ' HA3' ' A' ' 141' ' ' GLY . . . -135.32 85.6 2.18 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 175.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.497 ' C ' ' H ' ' A' ' 134' ' ' GLY . 13.1 t80 -149.13 116.45 6.11 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.462 ' HZ2' ' HG2' ' A' ' 93' ' ' LYS . 83.3 m95 74.04 -35.69 0.31 Allowed 'General case' 0 N--CA 1.477 0.919 0 O-C-N 123.908 0.755 . . . . 0.0 109.783 -169.046 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.497 ' H ' ' C ' ' A' ' 132' ' ' TYR . . . -117.63 -172.94 16.12 Favored Glycine 0 N--CA 1.43 -1.706 0 N-CA-C 108.184 -1.966 . . . . 0.0 108.184 177.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.62 ' HB2' ' HB2' ' A' ' 143' ' ' ASN . 0.8 OUTLIER -111.88 168.52 9.52 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 118.935 -1.106 . . . . 0.0 111.615 -175.863 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -79.18 36.24 1.96 Allowed Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.449 ' H ' ' C ' ' A' ' 135' ' ' ASP . . . 88.26 -14.75 58.5 Favored Glycine 0 CA--C 1.523 0.547 0 CA-C-N 114.935 -0.632 . . . . 0.0 114.329 177.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -111.89 -53.66 2.69 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 118.202 1.001 . . . . 0.0 113.601 -171.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 130.54 53.24 0.1 OUTLIER Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.346 -0.931 . . . . 0.0 112.479 -175.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.436 ' H ' ' CG ' ' A' ' 135' ' ' ASP . 60.8 tttp -172.92 37.43 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.208 0.528 . . . . 0.0 110.155 -178.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.46 ' HA3' ' HB1' ' A' ' 131' ' ' ALA . . . -123.42 -65.28 0.21 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 120.095 -1.05 . . . . 0.0 113.217 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.494 ' C ' ' H ' ' A' ' 144' ' ' ARG . 48.4 tttp -173.2 25.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 117.255 0.527 . . . . 0.0 112.211 175.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.62 ' HB2' ' HB2' ' A' ' 135' ' ' ASP . 9.9 t30 -51.54 5.65 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.19 1.396 . . . . 0.0 114.166 173.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.494 ' H ' ' C ' ' A' ' 142' ' ' LYS . 9.9 tpt180 -45.57 -21.02 0.08 Allowed 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 22.9 tp -57.58 -45.76 84.83 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.891 0.377 . . . . 0.0 110.496 174.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -62.64 -31.46 80.04 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.701 -0.559 . . . . 0.0 111.701 178.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -66.8 -39.76 87.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 175.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 70.1 mt -63.61 -42.56 98.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.953 176.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 98.8 mt -60.71 -45.52 93.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.831 178.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.553 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 71.5 mtm -67.25 -39.05 86.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.96 178.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -61.86 -45.38 94.01 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.126 0.489 . . . . 0.0 110.306 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 67.6 tp -64.58 -39.11 93.15 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.658 177.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.417 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 59.8 ttp180 -56.59 -49.8 73.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.314 177.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 150' ' ' MET . 14.1 mm-40 -62.13 -36.27 81.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.603 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -62.23 -56.13 21.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.313 176.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.491 HD22 ' NH2' ' A' ' 112' ' ' ARG . 37.3 mt -68.89 -25.14 64.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.098 -173.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -62.68 -52.39 63.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.107 173.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 73.0 mt -73.0 -38.26 55.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.794 -179.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -57.33 -47.39 81.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.477 177.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -79.61 -14.4 58.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.101 179.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 18.5 tp -76.76 -20.52 56.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.169 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -67.06 -0.04 2.94 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.869 177.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -16.33 51.08 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-O 121.009 0.433 . . . . 0.0 110.2 171.207 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -88.32 75.46 8.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 175.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -71.81 126.08 28.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.322 -170.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 67.25 -87.52 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.801 175.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 173.44 -52.14 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -177.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 75.8 t60 . . . . . 0 C--O 1.248 1.0 0 CA-C-N 114.44 -1.254 . . . . 0.0 108.325 170.88 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.479 0.976 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.501 ' O ' ' HB ' ' A' ' 3' ' ' VAL . 26.6 Cg_exo -61.99 87.29 0.1 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.905 2.403 . . . . 0.0 112.03 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.501 ' HB ' ' O ' ' A' ' 2' ' ' PRO . 14.9 p 165.97 -30.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.364 -176.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.9 mtm105 62.41 83.53 0.15 Allowed 'General case' 0 C--N 1.342 0.254 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.141 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.27 76.46 8.39 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.37 -176.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -89.43 133.67 34.43 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.752 175.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.5 mtp85 -103.09 125.78 49.97 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.924 0.392 . . . . 0.0 111.983 -176.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 75.5 mt -74.38 122.37 27.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 166.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.4 ' OE1' ' HA ' ' A' ' 9' ' ' GLN . 6.7 tp60 -69.41 86.74 0.44 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.823 0.344 . . . . 0.0 110.781 -176.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 67.95 136.22 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.72 -178.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 m -84.75 16.18 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.991 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 43.3 mtm 66.77 -100.43 0.06 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.746 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 179.37 148.21 0.24 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 62.51 10.38 3.99 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 123.421 0.45 . . . . 0.0 111.603 177.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.1 m -83.35 114.36 21.37 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.302 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 51.6 mt -96.68 114.08 32.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.777 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.7 mt -93.21 109.97 22.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.433 -175.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -96.41 103.56 15.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.763 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -109.15 127.11 53.92 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.234 -176.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -150.55 100.59 2.87 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.66 170.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 m 161.89 101.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.209 1.404 . . . . 0.0 108.291 -177.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.53 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 10.2 p -79.46 -55.4 5.08 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.646 0.26 . . . . 0.0 111.376 -176.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m 56.65 -95.35 0.05 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.676 -176.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -178.2 21.03 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.094 0.473 . . . . 0.0 110.576 178.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.9 p30 -136.97 -90.95 0.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -86.41 -4.95 59.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.57 0.7 . . . . 0.0 110.182 -173.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.53 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -73.31 -0.02 50.65 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.223 -0.898 . . . . 0.0 112.945 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.464 ' HA ' ' CB ' ' A' ' 33' ' ' ALA . 34.5 t70 -54.54 -23.57 17.16 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -176.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -64.88 -29.11 70.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.599 178.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.1 t -77.6 143.47 38.26 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -62.04 -30.91 71.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.934 0.397 . . . . 0.0 110.824 -174.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.515 ' HB3' HG21 ' A' ' 22' ' ' THR . 16.7 t80 -75.47 11.53 1.24 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.416 -173.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.464 ' CB ' ' HA ' ' A' ' 28' ' ' ASP . . . -73.83 106.0 5.36 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 175.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.525 ' HA ' ' HB ' ' A' ' 46' ' ' THR . . . -74.32 59.93 0.81 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.624 0.726 . . . . 0.0 112.522 -171.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 62.0 m95 -93.67 125.54 53.17 Favored Pre-proline 0 C--N 1.312 -1.06 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.742 172.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.55 125.37 17.17 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 122.678 2.252 . . . . 0.0 112.042 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.666 HG22 ' HA ' ' A' ' 104' ' ' LYS . 15.3 pt -114.99 141.87 30.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.872 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -100.05 100.1 10.93 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.426 HG12 ' OD2' ' A' ' 40' ' ' ASP . 4.5 t -124.04 127.08 73.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.11 -174.204 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD2' HG12 ' A' ' 39' ' ' VAL . 24.6 m-20 63.5 6.7 2.64 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.965 0.791 . . . . 0.0 111.913 176.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 114.02 -3.13 24.14 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.556 -0.83 . . . . 0.0 113.088 177.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -123.15 155.28 37.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.247 0.523 . . . . 0.0 111.065 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.6 m -94.73 119.98 34.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.448 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.487 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 37.9 m95 -109.13 124.21 34.69 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.445 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.612 ' O ' ' HB ' ' A' ' 46' ' ' THR . 4.8 Cg_exo -76.05 48.05 2.16 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.32 2.68 . . . . 0.0 113.683 -175.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.612 ' HB ' ' O ' ' A' ' 45' ' ' PRO . 1.6 t 129.57 160.69 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.5 1.52 . . . . 0.0 109.701 172.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 m -58.77 -38.78 79.25 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 123.563 0.539 . . . . 0.0 111.294 -177.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.438 ' H ' HG23 ' A' ' 46' ' ' THR . 14.1 mp0 -53.11 -43.1 66.61 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.305 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 32.2 m80 -64.53 -39.52 93.92 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.328 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -76.1 -46.5 28.61 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.582 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -60.03 -50.03 75.34 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.578 -178.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.424 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 6.9 tp-100 -64.63 -39.89 94.5 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.662 -177.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.918 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -68.71 -35.45 77.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.598 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -79.62 -16.84 55.1 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.909 0.385 . . . . 0.0 110.333 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.451 ' HE3' ' CD1' ' A' ' 89' ' ' TRP . 79.8 tttt -67.41 -21.8 65.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.793 -178.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.426 ' HZ ' ' CA ' ' A' ' 78' ' ' GLY . 82.2 m-85 -102.21 178.47 4.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.079 0.466 . . . . 0.0 111.901 -175.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.421 ' N ' HD12 ' A' ' 57' ' ' LEU . 5.6 mp -111.17 -37.01 5.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.642 -175.379 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.533 ' OD2' ' HB2' ' A' ' 61' ' ' TYR . 1.8 p-10 -75.5 111.65 11.02 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.602 0.715 . . . . 0.0 110.582 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -62.06 -32.85 73.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.658 -1.156 . . . . 0.0 111.791 -174.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.42 -37.9 76.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.105 0.479 . . . . 0.0 109.915 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.533 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . 2.0 t80 -77.06 -33.85 57.16 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.073 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.918 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 32.2 ttp85 -57.73 -44.84 86.3 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.372 0.606 . . . . 0.0 109.803 174.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -68.44 -31.57 70.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.233 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -70.14 -33.22 71.53 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.358 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 53' ' ' ALA . 75.2 mt -72.65 -23.19 20.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.005 0.431 . . . . 0.0 110.772 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.455 ' HB2' ' CZ3' ' A' ' 44' ' ' TRP . 55.3 ttp85 -84.33 -20.67 31.66 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.286 0.565 . . . . 0.0 109.637 171.299 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -75.99 -30.55 58.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.143 -177.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.9 p -78.47 129.31 37.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.92 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 43.9 t -77.19 -37.58 53.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.583 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.457 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.9 m -77.18 119.55 77.95 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 -177.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 22.1 Cg_exo -65.2 -37.59 31.24 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.844 2.363 . . . . 0.0 112.401 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.4 tpt -65.35 -41.15 94.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.819 -176.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 94.5 t -60.22 -38.05 75.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.129 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.437 ' HB1' HG23 ' A' ' 65' ' ' ILE . . . -60.81 -58.51 8.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.015 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 79' ' ' ARG . . . -60.98 -37.84 83.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.937 178.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.84 -49.92 73.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.73 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -78.42 -19.28 53.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.867 0.365 . . . . 0.0 110.967 -176.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.426 ' CA ' ' HZ ' ' A' ' 56' ' ' PHE . . . -93.85 0.03 66.82 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.41 176.528 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.459 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 33.1 ttt180 -89.95 -9.93 46.98 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -79.03 164.38 24.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.573 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.451 HH11 ' HD3' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -94.21 -5.99 45.71 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.275 -174.104 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.7 m -72.33 -8.04 52.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.171 0.51 . . . . 0.0 111.299 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -111.71 123.44 34.74 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.033 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.8 119.9 6.86 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.422 2.081 . . . . 0.0 111.185 173.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 59.2 mt -88.87 156.5 18.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.05 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.651 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 67.1 mtt180 -61.85 125.96 25.68 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 176.129 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -54.11 -44.13 71.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.933 -174.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -102.07 27.29 6.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.378 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.651 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 73.7 t-105 -58.15 -44.12 87.7 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.235 179.037 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -61.36 -21.95 64.5 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.591 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.9 m -80.55 -38.05 30.31 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.783 0.325 . . . . 0.0 110.874 177.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.4 m -97.32 1.91 10.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.087 0.47 . . . . 0.0 111.228 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -55.64 29.49 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.964 -178.368 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.82 -28.9 70.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.362 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -70.01 -51.35 32.99 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.795 0.331 . . . . 0.0 110.522 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 87.3 t -62.72 -39.3 84.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.4 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.463 ' HA ' ' CE ' ' A' ' 97' ' ' MET . 3.3 tpt -63.4 -43.21 98.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.203 178.394 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.629 ' HA ' HD11 ' A' ' 148' ' ' LEU . 56.7 ttp180 -61.8 -40.48 95.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.772 179.371 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -65.33 -50.53 65.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.765 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.82 -45.87 87.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.406 -177.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.488 HD12 HD12 ' A' ' 148' ' ' LEU . 35.0 mt -65.17 -37.66 88.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.994 -176.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.649 ' HG3' HD21 ' A' ' 156' ' ' LEU . 31.2 ttp85 -67.67 -36.58 80.98 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.365 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.582 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -66.2 -31.77 72.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.117 0.484 . . . . 0.0 109.989 177.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.666 ' HA ' HG22 ' A' ' 37' ' ' ILE . 59.7 tttm -62.77 -49.35 75.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.886 179.115 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 81.8 m-85 -82.32 -33.32 29.0 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -176.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -75.26 -19.25 59.82 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 121.944 -0.472 . . . . 0.0 111.567 -179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.582 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.0 OUTLIER -86.38 -46.39 10.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.77 0.319 . . . . 0.0 110.242 177.329 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -99.39 100.22 11.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.423 ' HB1' HH21 ' A' ' 112' ' ' ARG . . . -62.29 -31.83 72.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.399 -173.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.489 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.6 pm0 -68.87 -33.87 74.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.666 0.27 . . . . 0.0 110.661 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 57.9 mt -73.19 -35.99 66.48 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 176.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.487 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 28.0 ttp85 -58.17 -48.67 79.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.478 175.124 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.58 -40.03 93.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.593 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.6 tp -61.5 -43.45 98.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.633 178.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 39.5 tp -62.04 -56.42 19.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.629 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.3 mp -66.88 -16.55 64.38 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.991 -0.284 . . . . 0.0 111.5 -176.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -75.96 -13.2 60.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 60.7 p -89.23 -16.44 31.24 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 120.39 -0.524 . . . . 0.0 111.441 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.507 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -55.7 139.41 68.92 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.722 176.097 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -101.26 39.14 4.8 Favored 'Cis proline' 0 CA--C 1.535 0.548 0 C-N-CA 124.295 -1.127 . . . . 0.0 113.492 -1.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.04 153.56 42.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 0.0 111.151 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.525 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 56.3 tttp -86.98 122.98 31.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.035 -178.451 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 42.9 mt -91.2 125.13 35.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.527 -177.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 87.9 t -138.54 138.09 42.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.241 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -107.26 141.98 37.74 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -105.25 77.58 1.31 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.52 0.676 . . . . 0.0 109.612 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.69 86.36 5.3 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.731 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -78.02 -23.72 48.12 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.001 -174.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -83.69 -22.36 32.08 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -175.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -154.69 148.34 25.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.866 0.365 . . . . 0.0 110.824 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.581 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -106.56 87.43 2.53 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.621 -177.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.524 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 3.7 t80 -147.55 -37.75 0.2 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.852 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.571 ' HB3' HD22 ' A' ' 145' ' ' LEU . 7.1 m95 -134.45 32.55 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -176.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -162.21 -128.35 0.94 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 119.66 -1.257 . . . . 0.0 112.374 -177.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.31 -7.98 16.52 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.335 0.588 . . . . 0.0 109.688 174.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 70.69 6.06 58.16 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.539 178.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 83.58 11.4 80.0 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.303 -0.475 . . . . 0.0 112.467 -176.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -164.06 28.22 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.689 0.244 . . . . 0.0 111.14 -177.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 81.18 -51.31 4.34 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.558 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -80.7 58.32 3.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.174 0.511 . . . . 0.0 110.823 -175.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.581 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -123.3 15.26 8.18 Favored Glycine 0 C--N 1.318 -0.461 0 CA-C-N 115.754 -0.657 . . . . 0.0 113.85 -178.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.524 ' HD2' ' HA ' ' A' ' 132' ' ' TYR . 50.3 mttm 69.12 78.47 0.21 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.253 0.549 . . . . 0.0 111.375 178.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -70.06 5.31 1.67 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.335 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -18.62 37.76 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -177.247 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.571 HD22 ' HB3' ' A' ' 133' ' ' TRP . 43.1 tp -65.79 -53.0 46.12 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 118.239 0.472 . . . . 0.0 109.993 175.065 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -58.92 -39.56 94.22 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 177.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -64.69 -44.87 88.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.714 -0.243 . . . . 0.0 110.659 177.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 98' ' ' ARG . 1.7 tm? -60.44 -45.94 91.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 90.5 mt -56.37 -43.46 79.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.157 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.525 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 73.8 mtm -72.46 -43.47 63.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.13 -179.335 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -66.73 -39.5 87.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.988 0.423 . . . . 0.0 110.457 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.502 HD11 ' HB2' ' A' ' 102' ' ' ARG . 55.0 tp -66.47 -37.65 85.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.849 176.252 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.641 ' HG2' HH11 ' A' ' 153' ' ' ARG . 23.3 ttp85 -61.23 -36.11 79.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.397 176.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 150' ' ' MET . 49.7 mm-40 -58.64 -49.18 78.45 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.035 0.445 . . . . 0.0 110.229 174.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -62.68 -46.01 90.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.831 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.649 HD21 ' HG3' ' A' ' 102' ' ' ARG . 97.8 mt -64.22 -32.96 74.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.752 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.35 -61.32 1.84 Allowed 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.09 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 69.6 mt -58.0 -38.47 67.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -170.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -64.23 -33.36 75.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.024 0.44 . . . . 0.0 111.228 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -94.03 -20.16 20.2 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.574 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 26.0 tp -72.63 -32.95 66.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.68 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.5 ' OE2' ' HB2' ' A' ' 164' ' ' HIS . 9.2 tm-20 -49.14 -52.68 24.75 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.554 173.291 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 70.7 -16.51 0.33 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.866 167.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' HIS . . . . . 0.5 ' HB2' ' OE2' ' A' ' 162' ' ' GLU . 86.9 m-70 -73.53 -21.22 60.45 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -57.6 103.51 0.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.107 173.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -117.2 121.14 40.4 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.942 -177.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 -141.12 19.25 2.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.417 0.627 . . . . 0.0 109.625 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 . . . . . 0 C--O 1.244 0.811 0 CA-C-O 118.446 -0.788 . . . . 0.0 109.701 177.51 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 mmt . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 120.453 0.168 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -61.37 -38.64 62.98 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.542 2.161 . . . . 0.0 111.41 174.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.684 HG23 ' HB2' ' A' ' 25' ' ' ASP . 3.4 p -96.81 127.75 48.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 172.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 55.1 mtt85 -119.87 -36.85 3.2 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.114 -0.235 . . . . 0.0 111.235 -172.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.507 ' HB1' HD13 ' A' ' 114' ' ' LEU . . . 65.63 14.49 9.54 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.811 0.694 . . . . 0.0 110.472 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -100.96 17.2 22.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.833 -175.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.665 ' HB3' ' CD2' ' A' ' 26' ' ' TYR . 79.2 ttt180 -66.11 -35.36 80.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.286 0.565 . . . . 0.0 109.556 175.299 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.439 ' HB ' ' CZ ' ' A' ' 26' ' ' TYR . 67.1 mt -133.56 -65.74 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.294 174.735 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 73.56 -63.11 0.44 Allowed 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.917 0.76 . . . . 0.0 110.84 176.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -102.34 116.7 33.18 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 176.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.4 m -87.52 -175.14 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.113 -177.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.427 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 10.1 mtt -97.7 -85.41 0.36 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.587 -174.229 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.427 ' H ' ' HB2' ' A' ' 12' ' ' MET . 21.7 pt20 -177.97 114.68 0.08 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.873 179.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.9 t70 57.9 31.53 20.7 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.812 0.815 . . . . 0.0 110.289 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.5 m -76.33 146.4 38.85 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.766 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.2 mt -109.01 108.69 25.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.222 0.534 . . . . 0.0 110.516 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.4 mt -89.91 101.81 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.158 -175.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -97.45 101.15 12.62 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.123 172.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -101.19 154.06 19.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.823 -176.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -150.17 164.32 35.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.1 p 54.09 100.61 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.632 0.773 . . . . 0.0 111.843 -177.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -69.02 2.99 2.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.62 -175.007 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.0 p -56.41 -36.72 69.25 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -176.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -92.69 165.52 12.92 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.287 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.684 ' HB2' HG23 ' A' ' 3' ' ' VAL . 6.0 p-10 -82.57 2.17 34.45 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -171.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.665 ' CD2' ' HB3' ' A' ' 7' ' ' ARG . 0.9 OUTLIER -101.16 -4.4 27.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.187 0.518 . . . . 0.0 109.851 174.941 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -93.34 -0.23 67.77 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.682 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.462 ' CG ' HD22 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -58.0 -21.67 45.97 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -173.044 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.467 ' CZ ' ' HG ' ' A' ' 114' ' ' LEU . 97.1 m-85 -55.33 -21.73 16.25 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -177.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.531 ' HA ' ' OE2' ' A' ' 125' ' ' GLU . 22.8 t -62.42 141.68 58.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.097 0.475 . . . . 0.0 110.477 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -73.34 -21.38 60.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.751 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -90.81 6.08 45.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.176 0.512 . . . . 0.0 110.29 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.474 ' HB1' ' HD1' ' A' ' 35' ' ' TRP . . . -64.15 137.22 57.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.02 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.459 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -84.7 59.69 5.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.294 0.568 . . . . 0.0 111.136 -176.591 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.564 ' HB2' ' HE2' ' A' ' 104' ' ' LYS . 81.4 m95 -112.18 113.36 51.75 Favored Pre-proline 0 C--N 1.318 -0.796 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.882 176.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.58 125.65 19.73 Favored 'Trans proline' 0 C--O 1.237 0.475 0 C-N-CA 123.289 2.659 . . . . 0.0 112.785 -176.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.669 HG22 ' HA ' ' A' ' 104' ' ' LYS . 26.9 pt -115.95 146.44 20.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.681 179.115 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -109.72 103.32 12.13 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.4 t -122.77 124.06 69.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.705 -175.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 59.62 24.93 13.77 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 123.805 0.691 . . . . 0.0 111.085 178.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.27 -4.02 82.46 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.881 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -104.44 138.56 40.65 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 122.363 -0.492 . . . . 0.0 110.805 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.9 m -90.74 114.31 26.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.454 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.45 ' HB2' HG13 ' A' ' 37' ' ' ILE . 51.3 m95 -108.58 130.62 22.53 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.82 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 21.0 Cg_exo -65.95 -28.83 49.82 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.614 2.209 . . . . 0.0 112.467 -178.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.459 HG22 ' HA ' ' A' ' 34' ' ' ALA . 19.6 p -147.7 162.71 38.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.983 -177.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.1 m -66.85 -30.25 70.37 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.037 0.446 . . . . 0.0 110.616 178.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.402 ' OE1' ' HB3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -64.11 -28.99 70.15 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.611 -177.048 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.599 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 28.2 m80 -66.87 -41.81 86.68 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.971 -0.292 . . . . 0.0 110.845 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -70.9 -37.97 73.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.394 0.616 . . . . 0.0 109.511 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.524 ' HA ' HG11 ' A' ' 96' ' ' VAL . 78.3 t80 -61.35 -40.14 93.17 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.489 176.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.531 ' NE2' ' HA ' ' A' ' 75' ' ' ALA . 4.3 tp60 -72.28 -45.32 60.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.652 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.947 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -65.69 -38.91 90.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.168 -177.504 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.37 -16.94 44.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.582 0.215 . . . . 0.0 111.582 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.863 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.8 ttmp? -57.2 -38.39 73.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.156 0.503 . . . . 0.0 110.526 173.43 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -98.93 149.08 23.32 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.337 -178.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.803 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.3 pt? -95.71 1.95 53.71 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.244 0.545 . . . . 0.0 110.065 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -87.79 111.08 20.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.137 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.43 ' OE2' ' HD2' ' A' ' 62' ' ' ARG . 6.9 tp10 -60.43 -33.47 72.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.958 -177.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -62.71 -51.83 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.879 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.45 ' O ' ' HB3' ' A' ' 64' ' ' GLU . 0.5 OUTLIER -66.93 -29.8 69.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.018 0.437 . . . . 0.0 110.418 179.724 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.947 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.4 ttm180 -65.28 -41.32 94.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.122 175.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -62.96 -35.89 81.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.717 175.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 61' ' ' TYR . 11.4 tp10 -60.9 -55.43 33.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.905 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.55 ' O ' HG12 ' A' ' 68' ' ' VAL . 1.8 mp -61.98 -25.95 38.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 120.901 0.382 . . . . 0.0 111.309 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -71.87 -35.78 69.89 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 121.784 -0.572 . . . . 0.0 111.353 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -86.37 -0.03 55.04 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.702 -173.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.55 HG12 ' O ' ' A' ' 65' ' ' ILE . 11.9 p -95.59 117.54 39.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.32 0.581 . . . . 0.0 110.02 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.8 m -81.95 -24.97 35.25 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.991 0.424 . . . . 0.0 110.455 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.4 m -77.22 116.45 57.63 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.307 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.599 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 31.5 Cg_exo -59.85 -55.02 1.88 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.192 2.595 . . . . 0.0 113.064 -175.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 18.2 ttt -65.58 -22.84 66.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.498 -172.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 95.7 t -72.59 -37.79 57.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.838 0.351 . . . . 0.0 110.259 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.68 -45.81 92.74 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.051 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.531 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -62.2 -42.58 99.42 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.532 176.021 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -60.06 -55.91 28.08 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.579 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -74.78 -19.29 60.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.836 0.351 . . . . 0.0 111.121 -177.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -93.82 0.18 67.04 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.81 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 46.5 ttt180 -79.47 -0.61 33.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.196 0.522 . . . . 0.0 109.831 175.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -75.96 127.79 33.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.912 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.7 ttt180 -98.29 7.8 45.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.693 -175.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.2 m -83.01 -15.45 51.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.23 0.538 . . . . 0.0 110.344 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -79.32 150.24 73.63 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.147 179.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.429 ' HB2' HD21 ' A' ' 57' ' ' LEU . 18.3 Cg_endo -58.23 110.41 0.64 Allowed 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.657 2.238 . . . . 0.0 112.333 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.2 mt -85.99 120.77 27.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.829 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -68.63 134.0 49.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.257 0.551 . . . . 0.0 110.292 -178.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.51 -28.46 64.97 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.447 -170.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -90.88 16.88 8.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.561 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.484 ' CZ3' ' HA ' ' A' ' 55' ' ' LYS . 53.7 t-105 -58.98 -33.37 70.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.301 0.572 . . . . 0.0 109.871 174.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -56.63 -42.13 78.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.255 175.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 m -81.01 -43.34 19.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.69 -175.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.438 HG22 ' HA ' ' A' ' 89' ' ' TRP . 29.6 m -87.45 -3.46 9.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -170.435 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.48 ' HG3' ' N ' ' A' ' 94' ' ' GLU . 6.3 ptpp? -57.36 -36.88 71.78 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.839 0.352 . . . . 0.0 110.764 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.48 ' N ' ' HG3' ' A' ' 93' ' ' LYS . 7.6 pt-20 -78.41 -33.53 48.65 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.135 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -63.1 -43.77 97.57 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 -178.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.524 HG11 ' HA ' ' A' ' 51' ' ' PHE . 54.4 t -64.16 -49.17 82.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.382 176.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 10.1 mmt -61.45 -54.13 47.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.865 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -64.34 -27.09 68.79 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.789 -0.187 . . . . 0.0 111.314 -175.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -77.41 -46.38 22.85 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 176.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.64 -42.06 98.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.738 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 91.5 mt -64.88 -37.42 87.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.705 178.157 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.503 ' HA ' HD21 ' A' ' 152' ' ' LEU . 21.5 ttm-85 -63.46 -45.03 92.7 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 177.342 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.527 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -63.49 -38.37 90.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.781 0.324 . . . . 0.0 110.311 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.669 ' HA ' HG22 ' A' ' 37' ' ' ILE . 15.0 tptp -54.11 -56.3 19.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.499 176.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -80.64 -46.48 15.56 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -175.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.508 ' OE2' HD22 ' A' ' 156' ' ' LEU . 18.2 mm-40 -65.61 -21.56 66.59 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -175.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 35.7 tp60 -79.29 -44.48 21.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.096 0.474 . . . . 0.0 110.506 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 64.5 m-70 -99.54 112.23 24.47 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.924 -176.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -59.39 -32.16 69.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.844 0.354 . . . . 0.0 110.352 178.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.412 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.3 mp0 -58.01 -60.1 4.24 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.034 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.462 HD22 ' CG ' ' A' ' 28' ' ' ASP . 13.0 mt -69.44 -34.47 74.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.497 -175.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 108' ' ' HIS . 18.8 ttt180 -54.86 -54.67 39.41 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.137 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.13 -36.73 80.16 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.565 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.507 HD13 ' HB1' ' A' ' 5' ' ' ALA . 42.9 tp -58.09 -48.5 79.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.803 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.441 HD23 HD12 ' A' ' 156' ' ' LEU . 49.2 tp -58.61 -48.78 79.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.26 178.239 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.527 HD21 ' HB2' ' A' ' 156' ' ' LEU . 33.5 mt -70.16 -18.4 63.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.764 0.316 . . . . 0.0 111.339 -175.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -80.74 -14.82 57.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.682 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 72.9 p -73.74 -31.62 63.45 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.297 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.49 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -57.71 136.37 82.82 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.993 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.49 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 72.4 Cg_endo -100.44 72.13 0.16 OUTLIER 'Cis proline' 0 N--CA 1.455 -0.768 0 C-N-CA 124.267 -1.139 . . . . 0.0 113.529 -0.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -110.98 157.59 19.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.842 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.439 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 0.3 OUTLIER -83.58 140.96 31.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.172 176.04 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.479 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 67.7 mt -109.02 114.83 28.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.304 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 42.3 t -129.09 115.9 38.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.153 -177.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.531 ' OE2' ' HA ' ' A' ' 30' ' ' SER . 40.2 tt0 -80.73 133.63 35.7 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 172.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 45.1 t60 -121.75 119.47 31.8 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.194 -175.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 13.0 t -121.9 166.45 14.39 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 170.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.49 ' HA ' ' HA3' ' A' ' 137' ' ' GLY . 3.9 mp0 -116.34 4.93 13.48 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.946 173.412 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -124.63 110.97 15.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.524 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 25.7 t70 74.47 112.75 0.07 Allowed 'General case' 0 N--CA 1.465 0.291 0 O-C-N 124.563 1.164 . . . . 0.0 111.867 176.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.664 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -86.39 112.79 21.79 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.964 178.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -155.21 -68.49 0.12 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.452 -176.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.568 ' HB3' HD22 ' A' ' 145' ' ' LEU . 92.1 m95 -110.34 58.18 0.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.414 0.626 . . . . 0.0 109.504 177.321 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 131.31 156.73 8.57 Favored Glycine 0 N--CA 1.442 -0.95 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 -171.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.987 ' HA ' ' HA3' ' A' ' 141' ' ' GLY . 14.2 t0 -54.75 137.34 44.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.769 0.284 . . . . 0.0 111.715 -174.032 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -88.01 31.18 4.79 Favored Glycine 0 C--N 1.333 0.367 0 O-C-N 123.58 0.55 . . . . 0.0 111.988 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.49 ' HA3' ' HA ' ' A' ' 128' ' ' GLU . . . 78.98 54.48 4.12 Favored Glycine 0 C--N 1.317 -0.486 0 CA-C-N 114.838 -0.681 . . . . 0.0 114.076 177.196 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -174.79 -37.11 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 135.09 25.36 0.54 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 120.194 -1.003 . . . . 0.0 112.654 -175.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -156.68 91.01 1.19 Allowed 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.987 ' HA3' ' HA ' ' A' ' 135' ' ' ASP . . . -142.16 1.18 1.65 Allowed Glycine 0 C--N 1.312 -0.776 0 C-N-CA 119.614 -1.279 . . . . 0.0 114.604 -178.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.419 ' C ' ' H ' ' A' ' 144' ' ' ARG . 24.5 mtmm 65.29 88.96 0.1 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.634 0.73 . . . . 0.0 110.37 -176.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -67.56 5.21 0.84 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.378 178.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.604 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 5.9 mmt180 -54.09 -24.74 18.62 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.467 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.568 HD22 ' HB3' ' A' ' 133' ' ' TRP . 52.1 tp -65.89 -52.96 45.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.106 0.479 . . . . 0.0 109.893 175.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 123' ' ' LEU . . . -66.21 -28.3 73.59 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.658 176.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -64.71 -37.74 88.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 91.9 mt -69.8 -35.91 75.23 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.374 175.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.473 HD12 ' HA2' ' A' ' 146' ' ' GLY . 95.7 mt -61.59 -44.68 96.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.185 176.188 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.551 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 74.3 mtm -72.74 -30.95 64.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.782 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -62.32 -54.2 44.04 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.503 HD21 ' HA ' ' A' ' 102' ' ' ARG . 56.6 tp -61.25 -39.3 89.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.847 178.5 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -53.0 -55.32 24.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.045 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.551 ' HG2' ' O ' ' A' ' 150' ' ' MET . 11.4 mm-40 -62.36 -39.19 92.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.222 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -61.18 -45.66 93.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.507 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.684 ' O ' ' HG2' ' A' ' 160' ' ' LYS . 87.2 mt -64.55 -44.78 89.68 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.458 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.18 -51.47 68.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.165 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 154' ' ' GLU . 82.1 mt -55.78 -40.98 64.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 O-C-N 123.072 0.232 . . . . 0.0 110.632 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.2 -47.9 84.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.686 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.684 ' HG2' ' O ' ' A' ' 156' ' ' LEU . 46.6 mmtm -67.13 -35.23 79.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.739 -177.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.48 -23.23 65.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.513 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -81.61 4.85 20.05 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -175.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -72.47 87.8 1.2 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 122.232 1.015 . . . . 0.0 110.924 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -125.08 139.39 53.83 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.205 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -93.25 82.06 4.5 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.999 0.428 . . . . 0.0 110.664 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -119.85 26.28 9.42 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -78.2 73.2 4.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.589 0.709 . . . . 0.0 110.205 -178.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 78.6 t60 . . . . . 0 C--O 1.248 1.009 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.938 177.263 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.9 ttp . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.62 102.73 0.36 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.508 2.139 . . . . 0.0 111.866 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.54 125.4 28.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.085 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 72.9 mtm180 -115.66 11.36 15.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.556 -176.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.22 -25.29 65.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.45 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -81.61 35.52 0.41 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.582 -177.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -71.42 -45.53 62.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.815 0.341 . . . . 0.0 110.605 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.403 ' HB ' ' OH ' ' A' ' 26' ' ' TYR . 59.7 mt -89.12 89.15 3.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 175.517 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 23.7 pt20 -82.49 3.11 29.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.873 -174.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 p-80 -166.2 140.99 4.5 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 31.7 m -104.36 176.66 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 120.661 0.267 . . . . 0.0 110.675 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.43 ' N ' ' SD ' ' A' ' 12' ' ' MET . 0.2 OUTLIER -99.93 -96.68 0.25 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.801 -174.164 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -146.65 116.27 7.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.286 -177.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 48.11 36.84 7.03 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 123.708 0.63 . . . . 0.0 111.917 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.2 m -76.32 125.08 28.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.805 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.689 HG13 ' HD3' ' A' ' 122' ' ' LYS . 2.2 mp -85.49 116.77 29.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 174.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.0 mt -96.71 98.43 7.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.956 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.515 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 23.1 m120 -86.74 101.48 13.34 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 177.097 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.499 ' O ' ' HA ' ' A' ' 125' ' ' GLU . 49.7 p90 -103.8 146.48 28.56 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 177.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -150.34 141.58 23.2 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.503 -177.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 96.0 p 60.18 119.72 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.656 1.222 . . . . 0.0 112.358 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.777 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 0.6 OUTLIER -55.44 -64.66 0.77 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.931 178.61 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.3 m 45.87 -95.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.848 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -160.74 34.47 0.15 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 122.059 0.933 . . . . 0.0 108.556 -177.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -126.35 -145.29 0.32 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.167 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.403 ' OH ' ' HB ' ' A' ' 8' ' ' ILE . 0.2 OUTLIER -72.18 -1.42 15.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.424 178.613 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.777 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -60.64 -0.15 1.24 Allowed Glycine 0 CA--C 1.525 0.697 0 CA-C-N 115.787 -0.642 . . . . 0.0 114.524 -178.112 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -55.12 -25.48 31.98 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.011 0.905 . . . . 0.0 111.073 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -65.51 -36.95 85.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.763 174.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.0 m -57.32 145.69 31.38 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.511 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -81.22 10.85 4.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.868 -175.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -105.48 6.27 32.25 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.49 0.662 . . . . 0.0 109.481 175.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.519 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -71.43 141.92 50.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.635 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.62 52.53 1.91 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.101 0.477 . . . . 0.0 111.616 -176.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -108.26 106.65 59.04 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.957 177.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -56.48 139.57 87.54 Favored 'Trans proline' 0 C--O 1.238 0.522 0 C-N-CA 123.064 2.509 . . . . 0.0 112.547 -178.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.509 HG13 ' HB2' ' A' ' 44' ' ' TRP . 24.7 pt -119.98 131.66 71.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.746 -178.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -96.62 93.56 6.82 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 44.5 t -102.66 123.61 56.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.85 -176.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 58.99 24.29 12.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.329 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 97.09 3.88 58.82 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.711 176.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.465 ' HD3' ' HA ' ' A' ' 42' ' ' LYS . 25.0 mmtp -128.01 152.12 48.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.133 0.966 . . . . 0.0 111.822 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.0 m -91.63 113.83 26.2 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.557 -171.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.509 ' HB2' HG13 ' A' ' 37' ' ' ILE . 63.4 m95 -101.29 128.53 29.06 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 172.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.55 -39.02 90.25 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.933 2.422 . . . . 0.0 112.521 -176.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.82 171.28 17.97 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.066 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.8 m -69.86 -43.33 72.11 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -172.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.628 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -62.5 -31.7 72.5 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -175.76 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.489 ' HE2' HG13 ' A' ' 68' ' ' VAL . 19.7 m80 -55.06 -41.85 71.99 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.459 ' CE2' HG13 ' A' ' 96' ' ' VAL . 55.2 t80 -73.07 -40.63 64.89 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.276 178.102 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.481 ' HA ' HG11 ' A' ' 96' ' ' VAL . 54.2 t80 -61.92 -51.74 66.91 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.977 -179.429 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.628 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 11.3 mm100 -62.35 -40.09 95.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.946 -177.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.484 ' HB1' ' HB2' ' A' ' 62' ' ' ARG . . . -66.95 -27.6 67.6 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.155 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -84.38 -19.83 32.94 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.542 -177.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -64.28 -52.62 57.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.981 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.556 ' HE1' ' HG3' ' A' ' 83' ' ' LYS . 84.9 m-85 -69.85 153.1 43.76 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -169.373 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.447 ' N ' HD12 ' A' ' 57' ' ' LEU . 6.0 mp -97.94 -1.45 42.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.883 173.039 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.666 ' HB2' ' HB2' ' A' ' 61' ' ' TYR . 5.8 m-20 -86.8 110.78 20.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.524 176.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -60.56 -36.46 78.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.116 0.484 . . . . 0.0 109.882 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -62.36 -41.38 98.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.7 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.666 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 1.8 m-85 -64.81 -44.8 88.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.319 -0.4 . . . . 0.0 112.006 -175.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.484 ' HB2' ' HB1' ' A' ' 53' ' ' ALA . 5.1 ptp85 -66.75 -31.16 71.63 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.951 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -70.15 -35.88 74.36 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 174.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -64.7 -40.73 95.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.866 176.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.56 ' HA ' HG12 ' A' ' 68' ' ' VAL . 72.5 mt -71.88 -20.65 20.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.212 0.53 . . . . 0.0 110.525 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -77.7 -10.13 59.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.108 0.48 . . . . 0.0 110.44 173.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -110.75 -28.53 8.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.294 -178.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' A' ' 65' ' ' ILE . 13.5 p -62.64 121.38 11.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.53 0.681 . . . . 0.0 111.315 -176.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.1 m -85.09 -12.68 52.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.159 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.403 ' H ' HG22 ' A' ' 68' ' ' VAL . 26.1 t -102.23 124.04 41.12 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.056 -177.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.96 -34.45 59.41 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.897 2.398 . . . . 0.0 111.99 177.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 85.2 mmm -66.41 -37.47 85.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.179 -177.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 94.9 t -68.1 -41.23 84.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.539 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.26 91.63 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.37 177.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.466 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -59.61 -42.28 92.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.859 176.697 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -60.8 -45.11 95.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.021 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 66.8 mtt -57.47 -51.1 70.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.303 0.573 . . . . 0.0 110.728 178.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.492 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -73.23 -14.25 79.21 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.783 -177.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -73.32 -31.34 63.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.68 0.276 . . . . 0.0 110.534 -178.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -64.92 138.01 58.11 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.044 0.45 . . . . 0.0 111.384 -177.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.439 HH11 ' HD2' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.54 4.64 28.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.639 -177.04 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.1 m -83.44 -31.98 26.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 0.0 110.06 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.556 ' HG3' ' HE1' ' A' ' 56' ' ' PHE . 32.2 mmmt -65.14 146.88 98.86 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.862 177.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 32.4 Cg_exo -59.57 148.07 88.97 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.929 2.42 . . . . 0.0 112.598 178.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 98.2 mt -112.39 159.72 18.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.33 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.7 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 54.4 mtp180 -83.29 153.24 24.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.374 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.13 -34.06 75.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.883 0.373 . . . . 0.0 110.627 179.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.441 ' O ' HG22 ' A' ' 92' ' ' VAL . 10.5 p30 -100.87 12.95 36.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.31 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.7 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 55.0 t-105 -65.81 -17.56 64.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.145 0.498 . . . . 0.0 109.758 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -65.26 -39.48 92.68 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.341 176.673 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.0 p -99.17 -42.49 7.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.465 ' O ' HG23 ' A' ' 96' ' ' VAL . 32.6 m -67.96 -14.03 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -167.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.639 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 35.2 mtmm -51.87 -44.25 63.63 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.096 0.474 . . . . 0.0 111.131 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -80.46 -25.36 38.93 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.624 -175.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.445 ' OE1' ' HA ' ' A' ' 92' ' ' VAL . 1.7 mp0 -70.87 -40.68 72.14 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 174.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.481 HG11 ' HA ' ' A' ' 51' ' ' PHE . 84.3 t -63.96 -48.75 84.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.772 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.3 ttm -70.43 -30.67 67.59 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.303 -178.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.1 ttm-85 -63.9 -38.0 89.46 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -65.22 -42.82 93.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.627 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.91 -48.28 81.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.786 178.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.2 mt -62.46 -46.7 87.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.074 178.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.507 ' HA ' HD21 ' A' ' 152' ' ' LEU . 49.8 ttt85 -59.14 -51.98 67.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.555 -178.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -62.78 -29.85 71.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 0.0 111.151 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.509 ' HA ' HG22 ' A' ' 37' ' ' ILE . 88.3 tttt -64.2 -53.65 45.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.821 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 86.2 m-85 -77.69 -22.95 49.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.88 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.431 ' OE1' ' HG2' ' A' ' 102' ' ' ARG . 44.3 mt-10 -72.34 -49.88 30.96 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.128 -0.358 . . . . 0.0 110.917 175.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.2 OUTLIER -71.68 -26.03 62.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.893 -175.918 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -116.52 101.93 9.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.908 0.385 . . . . 0.0 110.111 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.13 75.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.816 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.4 pm0 -69.41 -30.52 68.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.805 0.336 . . . . 0.0 110.621 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 29.2 mt -74.59 -37.51 62.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.775 ' HG3' HD13 ' A' ' 156' ' ' LEU . 16.5 ttm180 -64.17 -44.29 92.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.924 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.93 -43.91 97.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.375 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.1 tp -57.68 -48.42 79.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.809 176.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.412 HD23 HD12 ' A' ' 156' ' ' LEU . 43.4 tp -57.65 -44.83 85.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.845 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.49 HD21 ' HB2' ' A' ' 156' ' ' LEU . 78.8 mt -69.5 -29.52 67.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.539 -178.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -70.31 -17.34 63.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.705 -178.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 47.5 p -72.61 -35.63 67.89 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.745 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -50.92 133.44 29.2 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.824 -179.047 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 48.4 Cg_endo -100.55 38.65 5.21 Favored 'Cis proline' 0 CA--C 1.535 0.574 0 C-N-CA 124.184 -1.173 . . . . 0.0 113.432 1.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -75.1 157.96 33.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.288 0.566 . . . . 0.0 111.099 178.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.689 ' HD3' HG13 ' A' ' 16' ' ' ILE . 86.7 tttt -95.39 122.8 38.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.264 -173.23 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.3 mt -90.27 119.27 30.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.787 0.327 . . . . 0.0 111.216 -175.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.515 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 60.5 t -136.75 119.36 20.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.731 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.499 ' HA ' ' O ' ' A' ' 19' ' ' PHE . 37.7 tt0 -97.38 116.94 30.54 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 171.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.556 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 1.3 t60 -87.1 77.11 9.18 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.354 -170.129 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 17.1 m -86.37 107.7 18.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.105 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.9 -28.5 11.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.61 -178.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -55.89 -42.44 75.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.52 177.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -140.42 136.18 32.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.432 -177.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -100.41 87.51 3.42 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.925 0.393 . . . . 0.0 110.844 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -146.55 -45.29 0.19 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.592 ' HB3' HD22 ' A' ' 145' ' ' LEU . 85.9 m95 -131.2 107.27 8.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.434 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 129.15 -149.77 18.65 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.031 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.556 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 3.8 m-20 -73.03 -28.83 62.57 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.97 0.414 . . . . 0.0 111.646 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 70.16 10.17 65.06 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 110.209 -1.156 . . . . 0.0 110.209 -168.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 92.29 -12.51 69.48 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 114.826 -0.687 . . . . 0.0 113.537 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 22.2 p-80 -144.45 0.75 1.03 Allowed 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -174.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 111.28 -50.49 0.77 Allowed Glycine 0 CA--C 1.517 0.196 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.619 178.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -81.45 61.31 4.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.706 0.765 . . . . 0.0 109.955 178.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -132.13 15.21 5.08 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.777 176.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt 70.44 79.61 0.18 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.326 0.584 . . . . 0.0 111.865 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -77.72 5.42 9.4 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.755 0.788 . . . . 0.0 110.12 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.637 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 46.1 mtm105 -62.98 -8.19 6.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.878 -177.276 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.592 HD22 ' HB3' ' A' ' 133' ' ' TRP . 66.5 tp -66.61 -49.09 67.44 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 168.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -59.09 -37.89 92.28 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 173.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' TYR . . . . . 0.41 ' HB3' ' HA ' ' A' ' 144' ' ' ARG . 88.2 t80 -63.75 -45.81 88.18 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.581 -0.31 . . . . 0.0 110.911 176.326 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 87.9 mt -56.77 -41.4 77.58 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.887 0.375 . . . . 0.0 110.399 178.132 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.96 -45.88 91.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.947 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.565 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 75.3 mtm -71.64 -36.57 70.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.235 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -62.81 -49.17 75.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.531 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.507 HD21 ' HA ' ' A' ' 102' ' ' ARG . 48.9 tp -66.16 -34.16 77.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.259 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 150' ' ' MET . 62.1 ttp180 -54.4 -48.81 71.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.693 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 150' ' ' MET . 5.7 mm-40 -59.96 -39.71 86.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.504 -178.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.78 -39.87 95.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.537 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.775 HD13 ' HG3' ' A' ' 112' ' ' ARG . 87.8 mt -78.29 -15.09 59.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.958 -178.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.419 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -79.69 -45.57 18.74 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 174.681 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 154' ' ' GLU . 63.5 mt -60.66 -29.28 44.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.104 177.446 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 159' ' ' GLU . . . . . 0.455 ' HB3' ' O ' ' A' ' 156' ' ' LEU . 5.5 tt0 -47.9 -53.83 14.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.408 174.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -80.71 -10.83 59.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.621 -174.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' LEU . . . . . 0.419 HD13 ' O ' ' A' ' 157' ' ' ALA . 8.2 mp -74.66 -22.01 59.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.022 0.439 . . . . 0.0 110.254 175.057 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -82.17 5.05 20.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.732 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 24.3 p-80 -63.09 -23.32 67.39 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.852 0.358 . . . . 0.0 110.881 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 51.3 t60 -118.88 26.05 9.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.438 0.637 . . . . 0.0 109.683 -178.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -124.06 -170.3 2.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.058 178.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 75.58 -72.59 0.1 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.486 0.714 . . . . 0.0 110.359 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -154.65 165.7 35.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.793 0.33 . . . . 0.0 110.766 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.452 -0.785 . . . . 0.0 109.735 176.456 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.4 mtt . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.412 ' O ' ' HG3' ' A' ' 4' ' ' ARG . 3.0 Cg_exo -75.02 107.93 2.6 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.394 2.062 . . . . 0.0 110.873 174.224 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.3 t -56.5 117.54 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.476 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 2' ' ' PRO . 44.4 mtm180 -115.44 97.2 6.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.314 -176.007 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.84 94.83 1.08 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 172.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -60.12 124.59 20.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.215 -174.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -95.17 99.93 11.82 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.379 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.66 115.78 20.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.524 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -58.76 -56.56 20.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.973 -177.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -154.1 132.83 12.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.35 -178.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.8 m -77.98 165.18 3.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.379 0.609 . . . . 0.0 111.291 176.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.732 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 13.8 mtt -95.39 50.42 1.24 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.047 -174.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 61.31 -94.88 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.886 -174.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -115.4 74.79 0.9 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.679 0.752 . . . . 0.0 109.317 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.732 ' HB ' ' HB2' ' A' ' 12' ' ' MET . 7.0 t -94.35 154.73 17.34 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.6 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.562 HG12 ' HB2' ' A' ' 122' ' ' LYS . 58.3 mt -111.1 123.6 67.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.029 0.443 . . . . 0.0 110.328 179.481 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.3 mt -101.7 105.57 18.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.107 -179.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.649 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 20.4 m120 -96.57 123.87 40.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.836 177.243 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -104.76 147.54 27.59 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.848 0.356 . . . . 0.0 110.863 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.599 ' HE1' ' O ' ' A' ' 126' ' ' HIS . 78.3 m-85 -126.99 114.29 17.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.652 -177.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.8 t 56.46 -150.18 0.44 Allowed 'General case' 0 CA--C 1.534 0.358 0 O-C-N 123.585 0.553 . . . . 0.0 109.702 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.515 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 26.0 p -89.45 -55.91 3.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 173.194 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.4 m 67.22 -69.68 0.13 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 174.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -129.9 179.75 5.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.181 -168.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -71.99 -27.4 62.73 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -73.38 -6.38 45.86 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.144 172.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.515 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -79.82 0.06 83.46 Favored Glycine 0 C--O 1.23 -0.129 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.653 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -49.14 -21.11 0.68 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.276 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -59.29 -21.8 60.22 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.947 0.403 . . . . 0.0 111.07 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.2 t -82.11 129.53 34.84 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.407 ' HB3' ' HB2' ' A' ' 47' ' ' SER . 42.0 m-80 -78.41 5.16 11.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.865 0.364 . . . . 0.0 111.514 -178.166 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -92.88 -3.17 55.07 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 175.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.16 136.66 52.45 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.925 176.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.68 60.82 4.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.42 0.629 . . . . 0.0 111.067 -174.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -104.02 120.88 49.68 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.591 175.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.484 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 30.8 Cg_endo -64.34 124.24 13.06 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.89 2.393 . . . . 0.0 112.523 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.6 HG22 ' HA ' ' A' ' 104' ' ' LYS . 25.9 pt -113.27 156.34 14.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.516 177.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -111.1 97.11 6.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.99 0.424 . . . . 0.0 110.258 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.545 HG13 ' HD3' ' A' ' 99' ' ' LYS . 87.8 t -119.04 122.85 70.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.23 -174.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 58.71 30.23 19.68 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 123.844 0.715 . . . . 0.0 110.839 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.5 14.82 75.26 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.754 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -126.16 143.13 51.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.894 0.347 . . . . 0.0 110.454 -179.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.3 m -91.5 115.74 28.29 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.348 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.503 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 72.9 m95 -105.23 133.18 20.28 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.926 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 8.9 Cg_exo -71.67 -11.26 27.76 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 123.071 2.514 . . . . 0.0 113.012 -177.035 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -165.6 146.6 7.06 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.407 ' HB2' ' HB3' ' A' ' 31' ' ' ASN . 14.7 m -57.59 -39.12 76.08 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.319 0.387 . . . . 0.0 111.107 178.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.406 ' OE1' ' HB2' ' A' ' 75' ' ' ALA . 41.4 tt0 -61.19 -28.01 68.83 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.675 -178.006 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.512 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 14.8 m80 -64.37 -44.74 90.41 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.847 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -74.19 -36.76 64.03 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.176 0.512 . . . . 0.0 110.005 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -61.61 -46.76 88.44 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.567 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.547 ' HB3' HD13 ' A' ' 65' ' ' ILE . 0.6 OUTLIER -71.72 -31.17 66.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.482 -178.941 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.4 ' HB1' ' HG2' ' A' ' 62' ' ' ARG . . . -65.97 -45.98 79.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.791 0.329 . . . . 0.0 111.001 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -77.2 -15.15 59.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.881 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 52' ' ' GLN . 87.1 tttt -63.22 -34.36 77.49 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.506 177.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -108.24 155.84 20.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.298 -178.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.696 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.5 pt? -108.1 11.84 27.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.13 -177.12 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -95.91 120.38 36.09 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 177.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.443 ' CD ' ' H ' ' A' ' 59' ' ' GLU . 1.5 mp0 -57.72 -43.51 85.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.606 -173.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 64' ' ' GLU . 86.3 tttt -64.76 -56.88 10.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.728 -176.012 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.424 ' CZ ' ' HE2' ' A' ' 83' ' ' LYS . 7.1 t80 -60.61 -35.74 76.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.197 0.522 . . . . 0.0 110.14 -178.325 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.543 ' HE ' ' HG3' ' A' ' 63' ' ' GLU . 2.6 tmm_? -58.48 -46.25 87.04 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.493 176.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.546 ' HA ' ' HB3' ' A' ' 66' ' ' ARG . 35.4 mt-10 -83.51 -7.17 59.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.917 -177.129 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 19.0 mm-40 -74.67 -39.32 62.08 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 169.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.547 HD13 ' HB3' ' A' ' 52' ' ' GLN . 54.7 mt -70.6 -26.19 28.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.602 175.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.546 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . 25.7 tpt180 -72.53 -29.58 63.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.506 172.284 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 25.9 ttm-85 -80.65 -37.41 30.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.889 -175.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.515 HG21 ' HB ' ' A' ' 73' ' ' VAL . 11.1 p -71.41 120.39 19.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.443 0.64 . . . . 0.0 111.332 -176.721 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.0 t -80.42 -36.19 34.05 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.533 178.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.7 m -69.72 124.35 90.42 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.744 -178.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.512 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 35.4 Cg_endo -65.53 -45.45 6.89 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.866 2.377 . . . . 0.0 113.083 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 25.0 ttt -63.75 -26.05 68.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.586 -174.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.515 ' HB ' HG21 ' A' ' 68' ' ' VAL . 54.2 t -72.53 -36.67 54.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.96 0.41 . . . . 0.0 110.16 178.254 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.98 -44.35 89.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.88 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.588 ' O ' ' HG2' ' A' ' 79' ' ' ARG . . . -57.45 -48.92 77.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.679 173.327 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -51.89 -64.06 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.842 -178.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -80.75 -4.88 56.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.134 0.493 . . . . 0.0 111.001 -175.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.52 -25.29 39.65 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 121.033 -0.604 . . . . 0.0 111.923 175.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.588 ' HG2' ' O ' ' A' ' 75' ' ' ALA . 58.6 mmt-85 -89.72 3.84 51.48 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 177.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -59.47 -42.85 92.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.798 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 71.25 -15.92 0.39 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.534 0.734 . . . . 0.0 112.341 173.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.1 m -90.27 23.61 2.84 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.219 0.533 . . . . 0.0 110.563 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.424 ' HE2' ' CZ ' ' A' ' 61' ' ' TYR . 12.3 mmmt -109.44 162.47 20.07 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 177.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.42 114.47 2.14 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.173 1.915 . . . . 0.0 112.154 178.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 92.5 mt -84.89 154.26 22.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.045 -177.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -82.34 144.8 30.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.957 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -69.39 -51.97 31.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.118 0.485 . . . . 0.0 111.011 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -86.59 27.56 0.95 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.939 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.465 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 41.3 t-105 -62.15 -23.42 66.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.571 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.448 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 40.5 mm-40 -76.18 -18.63 59.0 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.016 178.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.1 m -99.8 -19.13 16.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.858 -177.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.44 ' HB ' HG23 ' A' ' 96' ' ' VAL . 28.3 m -111.06 2.11 8.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -168.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 59.4 mttp -60.05 -59.91 4.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.448 0.642 . . . . 0.0 110.424 -179.509 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.567 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 1.4 pm0 -78.87 -17.19 56.01 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.04 -177.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.435 ' HB3' ' HA ' ' A' ' 92' ' ' VAL . 64.2 tt0 -77.75 -48.28 17.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.484 179.428 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.44 HG23 ' HB ' ' A' ' 92' ' ' VAL . 68.3 t -64.77 -40.85 90.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 120.963 0.411 . . . . 0.0 109.909 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.8 tpp -60.16 -39.08 85.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.483 177.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -63.59 -40.94 98.23 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.439 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.545 ' HD3' HG13 ' A' ' 39' ' ' VAL . 39.0 ttmt -63.48 -46.51 85.83 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 177.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.61 -43.58 98.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.643 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.704 ' HB3' HD22 ' A' ' 152' ' ' LEU . 35.4 mt -60.13 -49.63 76.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.464 178.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.594 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 32.1 ttt180 -64.84 -45.78 84.68 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.533 -178.61 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.44 -28.7 68.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.191 0.519 . . . . 0.0 110.786 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.6 ' HA ' HG22 ' A' ' 37' ' ' ILE . 53.9 tttm -70.24 -53.7 15.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.791 179.428 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -86.82 -0.03 55.69 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -177.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.864 ' HA ' HH21 ' A' ' 112' ' ' ARG . 1.8 mm-40 -92.08 -40.64 10.94 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.628 0.251 . . . . 0.0 110.846 172.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -71.26 -38.89 71.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.947 0.403 . . . . 0.0 110.758 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -109.33 110.19 21.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.155 -175.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.5 -24.03 63.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.176 176.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.445 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.4 mp0 -58.71 -54.17 50.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.718 176.181 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 27.9 mt -69.59 -35.53 75.42 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.478 -176.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.864 HH21 ' HA ' ' A' ' 106' ' ' GLU . 42.5 ttm180 -57.37 -47.47 81.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.876 178.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.74 95.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.643 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.0 tp -61.29 -47.53 85.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.507 178.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.27 -45.67 92.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.026 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.526 HD21 ' HB2' ' A' ' 156' ' ' LEU . 74.3 mt -68.43 -18.82 64.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.6 -177.395 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -77.9 -7.28 56.51 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 63.5 p -85.3 -32.73 22.36 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.514 -178.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.04 136.36 14.38 Favored Pre-proline 0 N--CA 1.467 0.42 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -100.4 35.54 7.16 Favored 'Cis proline' 0 C--N 1.349 0.567 0 C-N-CA 124.45 -1.063 . . . . 0.0 113.156 -1.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -66.26 149.5 50.26 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.652 0.263 . . . . 0.0 111.222 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.562 ' HB2' HG12 ' A' ' 16' ' ' ILE . 55.7 mttp -79.87 125.38 29.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.735 179.368 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 53.9 mt -90.62 100.97 13.72 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.649 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 98.8 t -133.45 126.86 52.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.962 -174.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.575 ' CD ' HG22 ' A' ' 127' ' ' THR . 0.0 OUTLIER -83.6 136.59 34.18 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 174.425 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.762 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 72.5 t60 -134.26 77.24 1.69 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.955 0.407 . . . . 0.0 110.051 172.256 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.575 HG22 ' CD ' ' A' ' 125' ' ' GLU . 8.9 t -112.97 130.46 56.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.292 0.568 . . . . 0.0 109.544 175.377 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.506 ' HG2' ' CA ' ' A' ' 137' ' ' GLY . 29.2 mt-10 -87.81 12.35 13.2 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.436 -175.129 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -91.24 -35.24 14.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.583 -178.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -152.44 135.6 15.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.78 0.324 . . . . 0.0 110.864 -177.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.563 ' HB2' ' HA3' ' A' ' 136' ' ' GLY . . . -110.58 91.72 3.77 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.298 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -153.75 -31.15 0.12 Allowed 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.115 -178.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.418 ' HB3' HD22 ' A' ' 145' ' ' LEU . 78.6 m95 -137.15 36.92 2.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.591 0.234 . . . . 0.0 111.54 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.502 ' HA3' ' CD ' ' A' ' 125' ' ' GLU . . . -174.08 -114.9 0.37 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.162 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.762 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 16.3 t70 -111.62 -33.73 6.27 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.895 0.379 . . . . 0.0 110.866 -176.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.563 ' HA3' ' HB2' ' A' ' 131' ' ' ALA . . . 74.2 6.5 74.85 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.031 177.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.506 ' CA ' ' HG2' ' A' ' 128' ' ' GLU . . . 78.7 40.69 17.26 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.917 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -178.02 -22.68 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLY . . . . . 0.422 ' HA2' ' OD2' ' A' ' 135' ' ' ASP . . . 127.28 -44.11 1.27 Allowed Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.222 -0.989 . . . . 0.0 113.043 174.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -91.37 68.39 5.83 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.778 0.799 . . . . 0.0 109.163 -177.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.456 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -123.1 14.89 8.31 Favored Glycine 0 C--N 1.311 -0.838 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.842 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 75.8 mttt 61.74 69.77 0.62 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.28 0.562 . . . . 0.0 111.732 173.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.464 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 7.6 t30 -72.92 5.54 3.21 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.337 -174.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.593 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 77.8 mtm-85 -48.07 -24.21 1.03 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.418 HD22 ' HB3' ' A' ' 133' ' ' TRP . 50.7 tp -57.25 -56.05 26.77 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.656 0.265 . . . . 0.0 110.764 174.142 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.55 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -64.49 -30.43 77.85 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 121.282 -0.485 . . . . 0.0 111.895 178.008 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -64.58 -42.3 95.69 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 95.3 mt -61.5 -41.24 96.98 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.095 175.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.87 -38.77 89.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.025 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 63.9 mtt -60.46 -51.25 70.26 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.162 0.506 . . . . 0.0 110.217 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -64.6 -41.02 96.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.849 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.704 HD22 ' HB3' ' A' ' 101' ' ' LEU . 54.7 tp -62.34 -42.04 99.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 178.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -59.48 -56.27 24.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.539 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.6 -32.99 70.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.049 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -64.25 -40.03 95.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.789 177.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.526 ' HB2' HD21 ' A' ' 116' ' ' LEU . 96.0 mt -77.69 -22.98 49.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.985 0.421 . . . . 0.0 110.613 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.41 -50.37 26.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.045 174.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 80.7 mt -65.05 -26.25 39.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.402 178.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -52.76 -40.72 63.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.602 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -74.58 -30.62 61.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.827 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.7 mp -70.75 -33.54 70.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.215 0.531 . . . . 0.0 110.361 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -79.4 -34.34 41.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.176 174.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 14.1 p80 40.86 49.84 2.96 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.806 0.842 . . . . 0.0 111.35 -178.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -149.96 85.43 1.41 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.704 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -81.24 169.01 17.87 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.577 -173.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -63.23 144.72 56.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.334 177.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 34.2 t-80 -64.45 -28.3 69.58 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.045 -177.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 19.2 m80 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 118.597 -0.715 . . . . 0.0 109.216 174.002 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -71.36 -28.37 18.25 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.346 2.031 . . . . 0.0 110.89 171.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 40.4 t -82.89 137.84 20.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.799 178.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.839 ' HB2' ' HB3' ' A' ' 25' ' ' ASP . 21.6 ttt180 -128.04 50.5 2.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.107 0.48 . . . . 0.0 110.249 177.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.474 ' HA ' HD13 ' A' ' 114' ' ' LEU . . . -74.84 58.63 0.84 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.562 0.696 . . . . 0.0 110.063 174.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -87.54 129.15 35.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.627 -177.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.484 ' O ' ' HG3' ' A' ' 7' ' ' ARG . 34.8 ptt180 -64.96 106.25 1.2 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.47 0.652 . . . . 0.0 111.324 -177.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.486 ' H ' ' HB1' ' A' ' 117' ' ' ALA . 57.1 mt -87.0 86.15 2.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 174.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.33 11.46 37.93 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.773 -179.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 35.7 t-80 -138.83 94.6 2.84 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.246 176.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.53 HG21 ' HD2' ' A' ' 120' ' ' PRO . 33.3 m -99.74 170.56 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.3 mtt -72.67 -74.53 0.16 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.618 0.723 . . . . 0.0 109.695 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -175.71 -56.45 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.955 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -125.59 72.59 1.28 Allowed 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.26 -1.337 . . . . 0.0 107.648 168.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.59 ' HB ' ' HB2' ' A' ' 121' ' ' ALA . 4.2 m -76.62 154.54 34.26 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.622 -170.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.9 mm -115.79 124.11 71.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.422 HG12 ' HB1' ' A' ' 121' ' ' ALA . 45.5 mm -106.9 101.72 12.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.029 178.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -100.48 104.43 15.82 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -118.01 137.98 52.51 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.45 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.579 ' CE1' ' HA ' ' A' ' 127' ' ' THR . 8.9 t80 -150.28 149.33 29.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.486 176.336 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.5 p 66.61 154.01 0.08 Allowed 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.669 1.188 . . . . 0.0 111.941 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.564 HG21 ' HA ' ' A' ' 33' ' ' ALA . 1.8 m -93.98 0.23 55.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.539 0.685 . . . . 0.0 109.841 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m -75.12 -32.15 61.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.397 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.83 161.03 24.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.468 177.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.839 ' HB3' ' HB2' ' A' ' 4' ' ' ARG . 2.8 m-20 -68.05 -24.68 65.1 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.637 -176.786 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -76.37 -1.36 26.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.788 175.261 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 30' ' ' SER . . . -65.98 -3.27 16.06 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.808 -0.633 . . . . 0.0 113.176 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -61.63 -30.29 70.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.122 0.461 . . . . 0.0 110.553 174.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -72.94 -23.82 60.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.852 177.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 27' ' ' GLY . 29.2 t -58.83 138.1 57.42 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.464 0.649 . . . . 0.0 111.48 -176.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -72.93 -17.09 61.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.705 177.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -90.51 -5.62 55.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.365 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.564 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -64.0 146.86 53.36 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.832 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.38 59.22 3.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.268 0.556 . . . . 0.0 111.719 -174.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -109.99 109.7 59.05 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.993 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.53 139.08 68.41 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.703 2.268 . . . . 0.0 112.178 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.497 HG22 ' HA ' ' A' ' 104' ' ' LYS . 27.2 pt -124.86 138.31 54.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.018 0.437 . . . . 0.0 111.275 -177.156 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.623 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 50.0 tptt -97.66 106.59 18.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.193 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.406 HG11 ' CZ ' ' A' ' 50' ' ' TYR . 15.9 t -126.44 126.84 69.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.45 -174.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 54.71 23.74 5.03 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 124.043 0.84 . . . . 0.0 112.141 173.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.04 -14.67 31.26 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.667 -0.777 . . . . 0.0 113.416 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -121.52 153.73 37.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.913 0.857 . . . . 0.0 111.322 -175.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 12.1 m -99.41 108.66 21.2 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.214 -176.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.472 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 48.3 m95 -97.99 135.18 21.54 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.607 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.585 ' O ' HG22 ' A' ' 46' ' ' THR . 11.4 Cg_exo -71.78 57.46 2.51 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.788 2.326 . . . . 0.0 112.412 176.768 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 45' ' ' PRO . 0.7 OUTLIER 92.98 170.11 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.672 1.589 . . . . 0.0 112.708 172.436 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 m -49.33 -47.82 46.93 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 114.33 -1.304 . . . . 0.0 112.517 -172.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -54.38 -33.53 59.38 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.917 0.389 . . . . 0.0 111.604 -175.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.413 ' CE1' ' HB2' ' A' ' 45' ' ' PRO . 44.7 m80 -75.66 -43.57 46.91 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 122.057 -0.402 . . . . 0.0 110.822 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.452 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 42.9 t80 -70.29 -26.28 63.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.952 0.406 . . . . 0.0 110.396 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.489 ' HA ' HG11 ' A' ' 96' ' ' VAL . 27.3 t80 -62.81 -52.87 61.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.512 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.78 ' HB3' HD13 ' A' ' 65' ' ' ILE . 2.4 mp0 -62.97 -34.39 77.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.594 174.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.684 ' HA ' ' HG2' ' A' ' 62' ' ' ARG . . . -65.72 -29.02 69.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.707 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -105.41 2.92 29.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.124 0.487 . . . . 0.0 110.06 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -83.71 -57.94 3.01 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.214 174.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.579 ' CE1' ' HB2' ' A' ' 83' ' ' LYS . 57.0 m-85 -88.02 143.24 27.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.505 -179.025 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.759 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.5 pt? -102.08 8.71 40.74 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.631 0.253 . . . . 0.0 111.657 -175.095 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -89.43 121.74 31.96 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.27 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -59.03 -44.86 91.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.443 -176.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -68.47 -52.73 29.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.508 -174.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -67.28 -30.74 70.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.857 0.36 . . . . 0.0 110.864 -178.337 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.684 ' HG2' ' HA ' ' A' ' 53' ' ' ALA . 5.3 tmm_? -68.67 -34.46 75.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.298 0.57 . . . . 0.0 109.5 177.685 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -67.18 -27.76 67.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.534 175.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.429 ' O ' ' HB3' ' A' ' 67' ' ' ARG . 1.3 tp10 -72.74 -28.61 62.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.231 176.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.78 HD13 ' HB3' ' A' ' 52' ' ' GLN . 37.9 mt -77.05 -22.24 14.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.276 0.56 . . . . 0.0 110.595 177.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -76.69 -19.74 57.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 170.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' A' ' 64' ' ' GLU . 7.3 tpp180 -75.78 -43.53 46.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.605 -179.291 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.7 p -63.86 120.34 10.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.334 0.588 . . . . 0.0 110.423 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.2 m -86.0 -31.72 21.89 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.289 -177.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.425 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 35.5 t -72.32 123.37 89.41 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.77 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 17.0 Cg_exo -67.8 -34.41 24.35 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.74 2.293 . . . . 0.0 111.652 177.054 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.473 ' HA ' ' CE ' ' A' ' 72' ' ' MET . 2.2 tpt -67.48 -47.25 70.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.521 -178.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.8 t -65.3 -37.48 80.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.46 -47.55 83.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.83 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.534 ' O ' ' HG3' ' A' ' 79' ' ' ARG . . . -66.7 -41.13 88.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.443 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.3 tpt180 -55.3 -53.73 52.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.032 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -80.2 -23.78 40.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.815 0.34 . . . . 0.0 110.775 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.56 -8.24 85.91 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.955 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 75' ' ' ALA . 89.7 mtt180 -89.34 -6.83 56.34 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 122.392 -0.475 . . . . 0.0 110.921 175.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -71.87 125.26 26.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.011 0.434 . . . . 0.0 109.955 176.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.659 ' HG3' HD11 ' A' ' 85' ' ' LEU . 14.5 ttm180 -96.9 15.58 21.82 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.554 -174.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.1 m -91.74 -8.04 48.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.931 178.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.579 ' HB2' ' CE1' ' A' ' 56' ' ' PHE . 45.2 mmtm -88.77 162.32 38.99 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.422 176.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 51.5 Cg_endo -68.7 100.92 0.72 Allowed 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 121.883 1.722 . . . . 0.0 112.532 -178.27 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.659 HD11 ' HG3' ' A' ' 81' ' ' ARG . 97.1 mt -84.35 150.13 25.58 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.686 174.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -82.28 143.35 31.38 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 174.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -57.99 -31.43 66.92 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -169.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -104.6 21.99 15.81 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 121.031 -0.268 . . . . 0.0 111.296 -176.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.451 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 43.3 t-105 -58.43 -48.53 80.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.451 -177.117 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.967 ' HA ' ' HE3' ' A' ' 93' ' ' LYS . 1.0 OUTLIER -55.99 -23.38 32.3 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -177.164 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.0 p -99.91 -17.37 17.62 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.9 m -105.53 7.05 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.967 ' HE3' ' HA ' ' A' ' 90' ' ' GLU . 97.6 mttt -59.5 -41.9 90.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.086 0.47 . . . . 0.0 111.061 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.494 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 5.0 pt-20 -73.0 -24.33 60.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.161 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -72.3 -43.36 64.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.162 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.489 HG11 ' HA ' ' A' ' 51' ' ' PHE . 62.7 t -62.12 -38.64 81.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.197 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 21.8 mmt -59.62 -38.84 82.41 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.814 176.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.494 ' HG3' ' O ' ' A' ' 94' ' ' GLU . 81.7 mtt180 -59.05 -44.97 91.87 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.996 0.427 . . . . 0.0 110.773 177.017 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 tmtp? -66.72 -49.52 65.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.575 -178.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.26 68.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.72 -176.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.493 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 41.7 mt -64.58 -36.14 83.26 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -177.302 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.571 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 70.8 ttt180 -65.09 -53.62 42.7 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.784 177.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.44 -32.93 67.4 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.99 0.424 . . . . 0.0 110.82 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.497 ' HA ' HG22 ' A' ' 37' ' ' ILE . 58.7 tttp -54.51 -52.78 60.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.958 175.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -82.42 -30.92 29.85 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.605 ' HA ' ' NH2' ' A' ' 112' ' ' ARG . 28.6 mm-40 -63.46 -49.15 74.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.59 0.233 . . . . 0.0 111.604 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.623 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 79.6 mm-40 -74.47 -20.88 59.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -175.411 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -116.1 105.02 12.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.808 0.337 . . . . 0.0 111.17 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.54 -27.75 69.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.194 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.445 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.5 mp0 -57.17 -51.27 70.0 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.69 175.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 67.2 mt -73.05 -39.18 66.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.958 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.605 ' NH2' ' HA ' ' A' ' 106' ' ' GLU . 35.1 ttm-85 -57.9 -44.73 86.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.856 0.36 . . . . 0.0 110.569 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.27 -41.26 94.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.806 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 5' ' ' ALA . 57.8 tp -62.53 -41.83 99.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.54 178.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 62.0 tp -65.16 -40.25 94.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.892 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.478 HD21 ' HB2' ' A' ' 156' ' ' LEU . 43.3 mt -81.05 -6.41 58.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.772 0.32 . . . . 0.0 111.042 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.486 ' HB1' ' H ' ' A' ' 8' ' ' ILE . . . -85.31 -31.99 22.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.069 177.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.9 p -72.9 -21.82 60.84 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.211 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.531 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -52.48 139.0 39.29 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.439 178.815 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.53 ' HD2' HG21 ' A' ' 11' ' ' VAL . 41.2 Cg_endo -100.1 40.66 4.16 Favored 'Cis proline' 0 CA--C 1.534 0.519 0 C-N-CA 124.371 -1.095 . . . . 0.0 113.241 -0.205 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.59 ' HB2' ' HB ' ' A' ' 15' ' ' THR . . . -66.77 154.69 40.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.302 0.572 . . . . 0.0 112.108 -177.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.31 119.21 23.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.61 179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 23.3 mt -86.31 112.78 21.73 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.804 0.335 . . . . 0.0 110.67 -176.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.8 t -129.13 127.24 65.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.073 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -97.55 129.19 44.71 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -91.22 77.36 5.95 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.579 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -77.57 86.22 3.9 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.966 -177.777 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -76.62 -18.25 58.71 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.769 -175.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -90.53 -29.88 17.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.622 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.441 ' O ' ' HB ' ' A' ' 127' ' ' THR . 8.9 t70 -145.51 138.87 26.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.816 -172.685 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.532 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -99.86 86.01 3.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 176.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -151.7 -34.87 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.954 -177.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.652 ' HB3' HD22 ' A' ' 145' ' ' LEU . 71.1 m95 -119.12 -0.23 11.12 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -172.271 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -155.39 -120.83 0.72 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 119.631 -1.271 . . . . 0.0 113.19 -172.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.516 ' HB2' ' HA2' ' A' ' 139' ' ' GLY . 1.2 p-10 -105.54 -10.21 17.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.957 0.408 . . . . 0.0 110.83 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 72.2 12.32 76.03 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.52 174.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 80.2 19.57 69.17 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.879 -178.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -163.42 19.21 0.07 Allowed 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLY . . . . . 0.516 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 79.86 -0.44 82.49 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 120.579 -0.82 . . . . 0.0 114.306 174.374 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -138.2 72.02 1.4 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.445 0.623 . . . . 0.0 110.121 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.532 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -129.07 15.15 5.88 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.558 -172.647 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.401 ' C ' ' H ' ' A' ' 144' ' ' ARG . 33.0 tttm 68.17 80.35 0.2 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.0 0.905 . . . . 0.0 110.523 179.197 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.38 5.33 1.81 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 114.363 -1.29 . . . . 0.0 110.906 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.659 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 24.5 ttt180 -48.09 -26.83 2.0 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.201 0.6 . . . . 0.0 112.576 -176.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 133' ' ' TRP . 37.6 tp -64.22 -48.57 75.35 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.058 0.456 . . . . 0.0 110.108 178.164 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -64.76 -29.05 74.21 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.549 177.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -70.2 -38.8 75.4 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 176.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.659 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 89.5 mt -58.26 -49.82 75.77 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.249 0.547 . . . . 0.0 109.531 174.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.49 HD21 HD13 ' A' ' 101' ' ' LEU . 96.4 mt -65.21 -31.3 72.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.881 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.6 tpp -61.92 -53.04 61.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.085 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -69.26 -33.97 74.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.538 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.428 ' O ' ' HG2' ' A' ' 155' ' ' GLN . 61.7 tp -60.74 -46.14 91.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.058 0.456 . . . . 0.0 110.071 175.332 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.531 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 54.0 ttp85 -58.83 -49.54 77.32 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.029 177.495 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.466 ' O ' HG13 ' A' ' 158' ' ' ILE . 44.4 mt-10 -71.66 -32.04 67.47 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -176.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 152' ' ' LEU . 9.3 pt20 -71.66 -32.19 67.64 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.427 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.478 ' HB2' HD21 ' A' ' 116' ' ' LEU . 84.5 mt -73.78 -25.81 60.32 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.462 ' O ' ' HB3' ' A' ' 160' ' ' LYS . . . -72.18 -43.64 64.24 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.055 173.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.508 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 87.2 mt -62.91 -42.91 98.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 175.426 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -58.14 -31.35 67.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.107 175.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.987 ' HA ' ' HE3' ' A' ' 160' ' ' LYS . 0.4 OUTLIER -66.86 -40.28 87.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.929 177.26 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.32 -23.31 65.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.666 177.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 158' ' ' ILE . 22.7 mm-40 -85.57 10.93 11.79 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.167 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.51 128.57 36.79 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.284 0.564 . . . . 0.0 111.638 -178.579 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -159.31 -23.09 0.07 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.518 178.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.439 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 5.1 m170 -125.6 80.07 1.87 Allowed 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 178.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.439 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 67.9 t60 -178.33 -101.28 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.225 171.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -155.55 -65.29 0.12 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -179.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 . . . . . 0 C--O 1.244 0.814 0 CA-C-N 115.095 -0.957 . . . . 0.0 108.475 171.336 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.8 mtp . . . . . 0 N--CA 1.48 1.038 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.29 162.87 39.38 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.196 1.931 . . . . 0.0 111.213 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.5 t -76.17 -32.76 23.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 4' ' ' ARG . 24.8 ttp85 60.23 54.02 4.19 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.19 178.442 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.1 77.66 4.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.228 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -75.48 116.99 16.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.953 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -100.5 135.46 41.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.333 -177.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.9 mt -63.26 145.52 13.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 173.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 -56.15 -54.36 46.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.365 0.602 . . . . 0.0 109.472 -178.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -167.87 139.64 3.0 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.292 174.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.405 HG21 ' HD2' ' A' ' 120' ' ' PRO . 35.0 m -59.46 146.7 9.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.277 0.56 . . . . 0.0 111.308 -179.092 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.4 mtm -94.14 22.66 5.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.391 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 68.42 -70.05 0.14 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.549 -173.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -77.9 44.79 0.48 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.88 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.9 m -97.75 113.32 25.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.625 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.7 mt -111.41 105.75 19.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 176.326 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 71.3 mt -92.67 102.02 13.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.728 -173.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.601 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 6.2 p30 -103.19 133.94 47.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.674 177.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -140.39 141.54 35.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.035 -175.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.668 ' O ' ' HB2' ' A' ' 21' ' ' SER . 6.6 t80 -150.27 100.22 2.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.182 165.083 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.668 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 6.0 t 150.19 110.7 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 124.85 1.344 . . . . 0.0 108.013 179.186 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.693 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 2.9 m -74.43 -70.26 0.41 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.1 m 47.46 -92.57 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.805 0.842 . . . . 0.0 113.087 174.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -157.24 27.27 0.3 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.524 0.678 . . . . 0.0 109.246 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.409 ' HA ' ' NH2' ' A' ' 4' ' ' ARG . 3.6 t70 -117.94 -153.16 0.52 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.166 -173.281 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -66.84 -1.31 3.78 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.018 0.437 . . . . 0.0 111.165 177.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.693 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -65.48 -0.45 6.29 Favored Glycine 0 C--O 1.225 -0.44 0 CA-C-N 115.749 -0.66 . . . . 0.0 113.504 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -56.48 -26.87 55.53 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 117.296 0.548 . . . . 0.0 111.315 175.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -66.55 -24.91 66.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.625 177.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.4 m -69.41 128.97 38.44 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 174.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 -76.09 10.52 1.89 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -172.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -95.01 2.2 55.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.223 0.535 . . . . 0.0 109.65 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.24 129.76 41.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.872 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.439 ' HA ' HG23 ' A' ' 46' ' ' THR . . . -86.8 62.89 7.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.414 0.626 . . . . 0.0 111.037 -174.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -102.15 125.51 36.36 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.563 175.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -61.61 116.78 3.65 Favored 'Trans proline' 0 C--O 1.239 0.563 0 C-N-CA 122.377 2.051 . . . . 0.0 111.119 174.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.586 HG22 ' HA ' ' A' ' 104' ' ' LYS . 26.1 pt -116.94 132.77 65.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.963 -178.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.962 ' HB3' HE21 ' A' ' 107' ' ' GLN . 5.0 tppp? -91.76 103.85 16.36 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 177.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.7 t -121.31 115.21 45.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.676 -177.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 64.64 14.82 9.3 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.568 176.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 114.57 -12.56 20.96 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.114 177.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -110.43 143.86 40.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 117.282 0.541 . . . . 0.0 111.564 -177.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.7 m -92.72 103.62 15.97 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.189 178.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.512 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 66.4 m95 -91.18 134.29 30.18 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.512 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 5.1 Cg_exo -76.44 -1.36 11.42 Favored 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 123.05 2.5 . . . . 0.0 112.743 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.439 HG23 ' HA ' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -169.73 150.31 3.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.202 -178.704 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.9 m -58.1 -40.68 81.78 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.318 0.386 . . . . 0.0 110.426 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.464 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 14.4 tp10 -57.68 -31.32 66.23 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.511 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.453 ' HE2' HG13 ' A' ' 68' ' ' VAL . 10.2 m80 -64.96 -43.9 91.15 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 122.074 -0.391 . . . . 0.0 111.138 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -72.3 -35.28 68.62 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 177.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.571 ' CD2' ' HE3' ' A' ' 55' ' ' LYS . 1.7 t80 -60.3 -46.5 89.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.557 177.122 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.601 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 79.2 mm-40 -57.88 -46.19 85.25 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.444 175.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.95 -33.4 68.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.521 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.42 ' HB3' ' HZ3' ' A' ' 89' ' ' TRP . 1.6 tp-100 -92.13 -14.58 28.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.741 -178.565 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.571 ' HE3' ' CD2' ' A' ' 51' ' ' PHE . 91.8 mttt -67.73 -38.52 83.65 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.044 0.45 . . . . 0.0 111.141 178.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -110.45 139.41 45.7 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.844 -174.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.847 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.8 pt? -89.53 -7.87 53.99 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.626 -175.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -73.03 138.83 46.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.949 0.404 . . . . 0.0 110.714 -177.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -72.0 -39.48 69.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.781 -175.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -82.86 -36.03 25.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.793 0.33 . . . . 0.0 110.54 -174.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.526 ' O ' HG12 ' A' ' 65' ' ' ILE . 4.9 t80 -66.52 -37.66 85.51 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.138 178.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 38.4 ttp-105 -66.78 -37.62 84.93 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.662 0.744 . . . . 0.0 109.696 174.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 34.0 tt0 -63.27 -33.19 74.97 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.294 175.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.421 ' OE2' ' HD2' ' A' ' 67' ' ' ARG . 5.7 tp10 -69.25 -36.1 76.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.965 177.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.526 HG12 ' O ' ' A' ' 61' ' ' TYR . 50.3 mm -60.66 -34.11 57.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.391 176.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -65.36 -32.92 74.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.973 175.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 45.9 mtt180 -81.7 -33.2 31.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.789 -172.398 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.453 HG13 ' HE2' ' A' ' 49' ' ' HIS . 7.2 p -68.8 112.57 3.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.351 0.596 . . . . 0.0 111.482 -176.297 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.6 m -71.98 -40.38 68.63 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.01 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 19.4 m -81.45 132.95 54.07 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.719 -173.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 20.9 Cg_exo -67.03 -44.18 5.52 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 123.179 2.586 . . . . 0.0 112.943 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.3 tpt -67.63 -36.8 81.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.753 0.311 . . . . 0.0 110.947 -173.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 67.2 t -62.71 -43.15 98.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.304 178.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.28 -43.43 91.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.399 177.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.64 -39.9 95.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.891 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.466 ' HD3' ' C ' ' A' ' 76' ' ' ARG . 1.9 tmt_? -61.52 -53.88 50.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.711 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -74.48 -15.61 60.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.777 0.322 . . . . 0.0 111.178 -176.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.601 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -93.94 -5.32 62.69 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.341 175.176 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 44.2 ttt180 -98.79 -5.84 30.44 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -81.54 118.92 23.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.686 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 34.0 ttm105 -92.95 66.73 4.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.503 0.668 . . . . 0.0 110.604 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 95.0 p -138.69 8.0 2.56 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.707 0.765 . . . . 0.0 109.06 167.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -99.99 160.05 28.22 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.535 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.46 101.61 0.54 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.151 1.9 . . . . 0.0 111.509 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 69.0 mt -77.5 136.82 38.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.899 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.54 ' HB3' ' HB2' ' A' ' 89' ' ' TRP . 16.8 ttt180 -66.98 131.81 46.64 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.136 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.425 ' HA ' ' HD2' ' A' ' 87' ' ' LYS . 20.1 tptp -62.9 -52.15 64.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.813 -172.052 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -89.64 20.34 4.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.501 0.191 . . . . 0.0 111.279 -177.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.54 ' HB2' ' HB3' ' A' ' 86' ' ' ARG . 63.7 t-105 -59.8 -33.35 71.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.947 0.403 . . . . 0.0 110.167 177.52 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.18 -40.65 77.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.333 179.215 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.5 p -85.82 -9.77 56.51 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -174.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.42 HG22 ' HA ' ' A' ' 89' ' ' TRP . 34.5 m -119.24 -4.43 10.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -176.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -53.21 -44.35 67.95 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.042 0.448 . . . . 0.0 111.676 -176.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 94' ' ' GLU . 5.6 pt-20 -83.28 -20.36 34.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.294 -175.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -75.43 -43.55 49.2 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 61.0 t -64.07 -41.89 93.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.99 177.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 52.6 tpp -58.51 -47.28 84.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.709 175.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -61.48 -42.78 99.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.954 -178.393 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.7 tttp -65.89 -45.36 82.3 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.817 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.55 -41.99 92.37 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.951 0.405 . . . . 0.0 110.73 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.474 ' HB3' HD22 ' A' ' 152' ' ' LEU . 17.5 mt -58.62 -48.65 80.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.309 177.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.9 ttt85 -58.97 -40.92 86.22 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.711 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.23 -37.15 82.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.126 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.586 ' HA ' HG22 ' A' ' 37' ' ' ILE . 27.1 ttpp -65.69 -42.69 90.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.64 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.603 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 82.3 m-85 -82.5 -24.12 34.32 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.244 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -77.74 -41.25 38.33 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 121.867 -0.521 . . . . 0.0 111.112 176.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.962 HE21 ' HB3' ' A' ' 38' ' ' LYS . 0.6 OUTLIER -83.31 -11.06 58.11 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.513 -176.276 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -129.24 105.25 8.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.048 0.451 . . . . 0.0 109.937 173.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.49 -30.32 70.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.025 -174.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -69.49 -34.2 73.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.814 0.34 . . . . 0.0 110.397 -179.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 36.2 mt -73.0 -38.19 66.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.611 177.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.603 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 22.7 ttm180 -59.8 -46.36 89.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.178 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.09 97.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.843 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.6 tp -58.13 -50.92 71.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.465 176.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 51.3 tp -58.74 -51.29 70.59 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.546 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.497 HD21 ' HB2' ' A' ' 156' ' ' LEU . 31.3 mt -68.5 -22.33 64.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.604 -174.05 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -78.26 -11.91 59.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.842 -178.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 68.8 p -80.52 -29.07 37.24 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.944 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -50.84 135.18 27.66 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.951 -178.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 68.9 Cg_endo -100.45 27.18 15.21 Favored 'Cis proline' 0 N--CA 1.458 -0.562 0 C-N-CA 124.338 -1.109 . . . . 0.0 113.2 0.131 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -58.57 150.94 21.67 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 120.92 0.39 . . . . 0.0 111.725 -177.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -87.29 117.71 26.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.49 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 31.6 mt -88.04 127.4 35.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.07 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.601 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 1.8 p -142.85 119.18 5.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.211 0.529 . . . . 0.0 111.007 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -91.57 131.52 36.93 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -91.99 77.13 5.43 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 119.544 -0.862 . . . . 0.0 108.767 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.73 86.13 5.35 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.544 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -85.96 -15.62 40.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.073 -176.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -82.98 -25.43 32.27 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.204 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -152.05 129.65 11.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.594 -176.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.51 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -100.03 85.71 3.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.867 -178.258 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -158.96 -26.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -177.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.523 ' HB3' HD22 ' A' ' 145' ' ' LEU . 49.1 m95 -131.52 22.01 4.72 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -168.01 -134.27 1.69 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 119.319 -1.42 . . . . 0.0 113.695 -177.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -76.09 -34.45 59.52 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.076 0.465 . . . . 0.0 111.095 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.52 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 79.67 -2.4 73.5 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.651 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 84.93 9.91 79.8 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 121.277 -0.487 . . . . 0.0 112.499 179.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -168.19 23.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.525 0.203 . . . . 0.0 111.103 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 88.14 -51.45 4.0 Favored Glycine 0 CA--C 1.522 0.473 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.591 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -84.53 62.64 7.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.697 0.761 . . . . 0.0 110.655 -177.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.52 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -123.41 15.25 8.13 Favored Glycine 0 C--N 1.315 -0.627 0 CA-C-N 115.221 -0.899 . . . . 0.0 112.548 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' A' ' 142' ' ' LYS . 11.1 mptt 63.02 71.33 0.52 Allowed 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 122.962 0.505 . . . . 0.0 111.506 172.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.561 ' OD1' HG23 ' A' ' 124' ' ' VAL . 6.3 t30 -71.92 5.71 2.47 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.284 -178.205 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.469 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 2.6 mpt_? -49.89 -22.05 1.37 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -179.018 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.523 HD22 ' HB3' ' A' ' 133' ' ' TRP . 62.8 tp -59.23 -45.5 90.98 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.613 0.244 . . . . 0.0 110.598 175.354 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.604 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -63.52 -30.83 78.77 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.751 176.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -71.77 -36.97 70.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 98.2 mt -62.14 -36.79 82.86 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 174.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.34 -38.81 92.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.337 174.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.604 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 58.1 mtt -64.04 -46.53 84.01 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 177.373 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -56.54 -51.08 69.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.583 177.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.474 HD22 ' HB3' ' A' ' 101' ' ' LEU . 56.4 tp -63.55 -48.42 77.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.879 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -56.77 -41.07 76.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.872 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.445 ' O ' HG13 ' A' ' 158' ' ' ILE . 1.4 tp10 -61.39 -52.54 64.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.151 -178.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -65.34 -35.48 81.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.53 -175.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.497 ' HB2' HD21 ' A' ' 116' ' ' LEU . 87.4 mt -72.47 -35.01 68.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.856 0.36 . . . . 0.0 110.317 179.398 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.411 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -68.43 -47.85 66.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.506 177.609 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 154' ' ' GLU . 73.4 mt -62.24 -37.95 79.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.422 179.009 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -63.3 -31.8 73.05 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.34 0.59 . . . . 0.0 110.09 177.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -82.77 -12.27 57.64 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.716 179.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 157' ' ' ALA . 7.8 mp -96.51 -35.55 11.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.839 177.1 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.25 -37.02 79.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.874 -177.177 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.469 ' HB2' ' HB2' ' A' ' 167' ' ' HIS . 16.7 p-80 -74.18 0.33 14.34 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.85 -174.214 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -61.81 -31.53 71.77 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.187 0.518 . . . . 0.0 109.797 177.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -117.08 -64.95 1.24 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.473 0.654 . . . . 0.0 109.471 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -80.12 98.17 7.18 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.872 -176.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' HIS . . . . . 0.469 ' HB2' ' HB2' ' A' ' 163' ' ' HIS . 34.3 t-80 177.81 -29.22 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.012 179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 . . . . . 0 C--O 1.246 0.912 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.474 179.664 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.478 0.955 0 CA-C-O 120.596 0.236 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.88 95.56 0.97 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.337 2.025 . . . . 0.0 111.255 175.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.457 ' HA ' ' CG ' ' A' ' 25' ' ' ASP . 56.8 t -55.69 113.93 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.955 -174.03 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.42 HH21 ' CG ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -83.65 86.45 7.12 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 173.908 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.64 76.55 10.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.066 -175.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -85.7 84.21 7.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.267 0.556 . . . . 0.0 109.706 176.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -95.05 106.91 18.95 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.675 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 21.1 mt -80.44 83.39 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.281 -171.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -70.87 -19.12 62.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.412 0.625 . . . . 0.0 109.807 176.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -107.96 71.53 0.81 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.626 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 5.5 m -83.47 149.62 4.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 171.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.429 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 0.6 OUTLIER -66.21 -80.21 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.072 -176.645 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.429 ' H ' ' HB2' ' A' ' 12' ' ' MET . 49.2 tt0 -169.32 83.38 0.13 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 173.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.3 t70 62.9 99.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.968 0.793 . . . . 0.0 110.114 -173.129 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.9 t -120.56 148.08 44.33 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.63 HG13 ' HD2' ' A' ' 122' ' ' LYS . 3.9 mp -86.34 104.74 14.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.968 0.413 . . . . 0.0 110.049 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.6 mt -90.03 89.93 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-O 121.281 0.562 . . . . 0.0 109.881 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.4 p30 -84.16 102.06 12.3 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 171.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -100.7 137.27 39.32 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.625 -171.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -150.72 -179.34 7.18 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.578 175.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 48.2 m 66.48 93.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.671 0.748 . . . . 0.0 110.666 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.439 HG21 ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -81.39 3.41 24.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.962 -176.025 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 m -46.12 -47.47 17.39 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.348 -0.842 . . . . 0.0 113.255 -175.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.42 ' CG ' HH21 ' A' ' 4' ' ' ARG . 2.6 p-10 -115.11 -175.47 2.7 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.921 -0.487 . . . . 0.0 110.996 -179.478 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.457 ' CG ' ' HA ' ' A' ' 3' ' ' VAL . 5.0 m-20 -66.35 -26.39 67.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.915 -172.244 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -70.05 -15.57 63.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.292 0.568 . . . . 0.0 110.277 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -87.17 -0.27 85.3 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.222 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.87 -25.78 63.64 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -56.95 -25.83 58.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.7 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.3 m -70.3 141.85 52.3 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.949 0.404 . . . . 0.0 110.486 177.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -59.06 -33.34 70.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.221 0.534 . . . . 0.0 110.971 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -85.96 20.86 2.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.31 -173.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.439 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -70.21 138.65 51.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.787 0.327 . . . . 0.0 111.144 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.541 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -94.53 64.86 3.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.384 -175.068 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -117.17 122.87 30.65 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.992 174.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.14 127.66 24.91 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 122.864 2.376 . . . . 0.0 112.532 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.543 ' CG2' ' HA ' ' A' ' 104' ' ' LYS . 11.6 pt -123.9 141.61 43.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.053 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -102.57 87.83 3.09 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.472 HG22 ' HB3' ' A' ' 103' ' ' ALA . 16.0 t -108.41 130.07 61.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.838 -173.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 t70 64.87 26.39 12.87 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.777 0.673 . . . . 0.0 110.159 175.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 77.69 14.36 82.49 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.147 -178.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.9 mttp -125.46 148.71 48.73 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -176.319 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 35.9 m -93.16 126.46 38.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.702 0.287 . . . . 0.0 111.193 -178.1 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.446 ' HB2' HG13 ' A' ' 37' ' ' ILE . 35.4 m95 -125.59 133.55 24.99 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.322 178.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 11.9 Cg_exo -71.08 -29.95 16.98 Favored 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 122.763 2.309 . . . . 0.0 112.433 178.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.541 HG22 ' HA ' ' A' ' 34' ' ' ALA . 4.8 p -145.92 169.63 18.22 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.326 -177.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 m -69.42 -44.99 70.24 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.4 0.437 . . . . 0.0 111.971 -173.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.412 ' CD ' ' HG1' ' A' ' 46' ' ' THR . 0.4 OUTLIER -67.35 -15.17 63.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -173.814 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.413 ' O ' HG21 ' A' ' 65' ' ' ILE . 10.5 m80 -63.55 -52.18 62.21 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 174.485 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -65.96 -37.01 84.9 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.148 0.499 . . . . 0.0 109.931 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.53 -50.11 70.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.424 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -69.84 -37.03 76.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.382 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.597 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -62.83 -54.49 38.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.058 -175.282 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -73.63 -26.88 60.98 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.804 0.335 . . . . 0.0 110.417 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -56.07 -45.41 79.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.358 172.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -76.09 124.25 27.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.98 176.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.841 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.0 OUTLIER -81.05 -15.64 55.52 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.775 179.552 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -78.01 126.23 30.52 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 62' ' ' ARG . 10.7 tp10 -67.22 -38.17 84.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.504 -173.178 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.412 ' O ' ' HB3' ' A' ' 63' ' ' GLU . 41.7 mttm -83.41 -25.4 31.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -175.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.534 ' OH ' ' HE3' ' A' ' 83' ' ' LYS . 0.3 OUTLIER -80.82 -23.28 39.32 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.355 -0.938 . . . . 0.0 109.918 173.785 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.597 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 24.9 ttp180 -68.98 -35.58 76.89 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 167.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.412 ' HB3' ' O ' ' A' ' 60' ' ' LYS . 42.1 tt0 -64.83 -36.24 83.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.037 174.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.433 ' CD ' HH21 ' A' ' 67' ' ' ARG . 5.9 tp10 -58.93 -42.89 90.83 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.434 173.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.413 HG21 ' O ' ' A' ' 49' ' ' HIS . 45.6 mm -60.35 -37.13 73.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.979 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -72.15 -32.11 66.59 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.028 0.442 . . . . 0.0 110.415 175.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.433 HH21 ' CD ' ' A' ' 64' ' ' GLU . 35.1 ttp180 -70.57 -26.5 63.56 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.177 -175.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.2 m -87.49 121.97 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 121.485 0.66 . . . . 0.0 110.987 178.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.0 p -83.33 -13.42 55.12 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 173.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.9 m -85.89 117.48 68.8 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.455 -176.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.64 -46.62 0.82 Allowed 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 123.056 2.504 . . . . 0.0 111.954 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.9 tpt -62.51 -33.07 74.15 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.295 -176.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 93.9 t -69.29 -43.36 81.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.199 178.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.71 -38.74 92.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.619 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.99 -45.97 86.64 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.864 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 76' ' ' ARG . 42.4 mtm180 -62.59 -48.22 80.37 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.634 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.777 ' HA ' ' HB2' ' A' ' 80' ' ' ASP . 26.6 ptt? -75.47 -11.06 59.96 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.458 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.32 -32.01 65.56 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.284 -0.726 . . . . 0.0 111.284 169.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -96.64 11.13 36.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.613 0.244 . . . . 0.0 110.918 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.777 ' HB2' ' HA ' ' A' ' 77' ' ' MET . 28.1 t70 -67.2 -19.54 65.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.738 -175.075 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 74.29 -41.29 0.47 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.653 0.781 . . . . 0.0 111.966 177.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.8 m -83.06 33.15 0.44 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.183 0.516 . . . . 0.0 111.176 -178.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.534 ' HE3' ' OH ' ' A' ' 61' ' ' TYR . 47.4 mmtm -123.32 158.78 57.38 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.698 -178.327 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.18 103.04 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.603 2.202 . . . . 0.0 112.754 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 83' ' ' LYS . 73.7 mt -105.55 154.49 20.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.978 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.563 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 52.7 mtt180 -99.03 136.27 39.24 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.88 0.371 . . . . 0.0 110.866 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -60.95 -33.7 73.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.855 175.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -95.91 11.45 33.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.99 -176.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 61.8 t-105 -63.92 -33.58 76.04 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.479 -174.129 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.82 -23.52 66.7 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.921 0.391 . . . . 0.0 110.681 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.7 m -91.87 -46.05 8.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.235 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.78 2.36 5.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.662 0.268 . . . . 0.0 111.705 -175.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 89' ' ' TRP . 35.1 ttmt -55.75 -53.64 54.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.597 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -62.46 -35.0 77.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.089 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -66.63 -51.59 54.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.696 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.2 t -64.31 -40.57 89.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.29 178.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.481 ' HA ' ' CE ' ' A' ' 97' ' ' MET . 2.1 tpt -59.29 -48.85 80.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.677 178.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 44.5 ttp180 -62.48 -35.85 80.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.321 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -64.04 -45.57 88.26 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.153 0.501 . . . . 0.0 110.248 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.52 -42.98 95.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.549 177.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 97' ' ' MET . 92.8 mt -62.05 -36.16 80.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.156 178.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.518 ' HG3' HD11 ' A' ' 152' ' ' LEU . 59.2 ttp85 -62.63 -49.17 76.23 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.186 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.508 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -66.83 -29.75 69.76 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.185 0.517 . . . . 0.0 110.236 -178.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.543 ' HA ' ' CG2' ' A' ' 37' ' ' ILE . 57.5 tttp -59.91 -59.18 5.83 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.296 177.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.51 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 90.2 m-85 -80.07 -40.54 27.43 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.542 ' HA ' ' HD3' ' A' ' 112' ' ' ARG . 2.4 tm-20 -69.73 -37.99 76.69 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 121.154 -0.219 . . . . 0.0 111.385 -173.064 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 28.3 tp60 -65.05 -35.74 82.14 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.045 0.45 . . . . 0.0 110.552 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -108.83 101.45 10.56 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.91 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -53.25 -34.42 57.08 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 112.077 -175.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.78 -44.91 86.56 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.068 177.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 68.1 mt -73.73 -38.87 64.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.525 -177.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.702 ' HG3' HD13 ' A' ' 156' ' ' LEU . 41.9 ttp180 -62.15 -47.98 82.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.531 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.81 -34.67 77.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.023 0.44 . . . . 0.0 110.391 178.139 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 50.5 tp -63.29 -41.62 98.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.15 177.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 32.2 tp -63.49 -49.25 74.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.304 178.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.98 -19.16 65.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.556 -178.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.29 11.21 12.68 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.5 0.555 . . . . 0.0 112.5 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 75.7 p -101.41 -25.39 13.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.887 0.375 . . . . 0.0 110.762 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.443 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -51.33 137.99 28.91 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.691 -178.665 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.44 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 90.2 Cg_endo -99.41 31.25 11.35 Favored 'Cis proline' 0 N--CA 1.458 -0.567 0 C-N-CA 124.276 -1.135 . . . . 0.0 113.306 -0.11 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.23 154.44 38.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.764 0.316 . . . . 0.0 111.274 -178.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.63 ' HD2' HG13 ' A' ' 16' ' ' ILE . 61.4 mttp -80.01 134.55 36.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.075 179.472 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.458 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 80.8 mt -102.97 113.69 27.37 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.125 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.51 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 26.6 t -131.95 116.25 29.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.503 -178.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -78.87 111.99 15.58 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 174.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.616 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 86.4 t60 -91.61 77.27 5.68 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -177.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.473 HG23 ' O ' ' A' ' 127' ' ' THR . 10.4 t -83.63 92.08 7.59 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 122.328 1.061 . . . . 0.0 109.106 177.147 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -79.96 59.22 3.14 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.189 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -144.48 -51.55 0.29 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.584 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -153.67 128.91 9.75 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.184 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.575 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -76.76 105.47 7.84 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.068 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -151.03 -46.14 0.12 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 120.642 -0.423 . . . . 0.0 112.128 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.702 ' HB3' HD22 ' A' ' 145' ' ' LEU . 7.8 m95 -126.54 35.19 4.68 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -176.359 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -172.31 -123.1 0.69 Allowed Glycine 0 CA--C 1.506 -0.519 0 C-N-CA 119.237 -1.459 . . . . 0.0 112.87 -177.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.518 ' HB2' ' HA2' ' A' ' 139' ' ' GLY . 1.5 p-10 -107.13 -17.11 14.25 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.308 0.575 . . . . 0.0 109.576 176.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.424 ' HA3' ' HB2' ' A' ' 131' ' ' ALA . . . 64.6 18.94 64.32 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.773 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.616 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 86.11 10.89 74.01 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.042 -0.599 . . . . 0.0 113.303 -179.438 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -163.72 23.08 0.08 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 117.453 0.627 . . . . 0.0 112.206 -178.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLY . . . . . 0.518 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 81.65 -49.82 4.13 Favored Glycine 0 CA--C 1.524 0.611 0 C-N-CA 120.86 -0.686 . . . . 0.0 113.703 176.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -81.14 60.24 4.2 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.642 0.734 . . . . 0.0 110.275 -175.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.575 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -125.31 15.41 7.25 Favored Glycine 0 C--N 1.317 -0.499 0 CA-C-N 115.277 -0.874 . . . . 0.0 113.495 -179.267 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 67.1 mttm 70.44 79.47 0.18 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.547 0.689 . . . . 0.0 111.006 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.81 5.34 2.61 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.084 -177.504 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.479 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 3.7 mmp_? -54.61 -29.96 53.32 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.702 HD22 ' HB3' ' A' ' 133' ' ' TRP . 54.2 tp -61.18 -49.91 75.29 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.051 0.453 . . . . 0.0 110.463 177.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.615 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -61.23 -32.51 80.9 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.973 177.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -72.9 -36.81 67.38 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.594 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.6 mt -59.43 -37.23 77.55 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.531 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.57 -39.89 94.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.663 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.615 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 52.9 mtt -64.73 -50.5 66.65 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.096 0.474 . . . . 0.0 110.275 177.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -60.42 -43.2 96.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.933 -178.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.518 HD11 ' HG3' ' A' ' 102' ' ' ARG . 44.8 tp -65.24 -40.84 94.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.462 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.443 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 51.6 ttp85 -56.69 -44.67 81.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.771 178.123 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.495 ' O ' HG13 ' A' ' 158' ' ' ILE . 26.2 tt0 -71.78 -36.05 70.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.521 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 58.3 tp60 -61.66 -43.12 99.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.089 0.471 . . . . 0.0 110.292 176.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.702 HD13 ' HG3' ' A' ' 112' ' ' ARG . 93.1 mt -71.56 -29.83 65.18 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.55 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.433 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -63.42 -38.67 92.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.375 176.124 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 154' ' ' GLU . 75.1 mt -57.97 -43.26 84.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.56 176.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 159' ' ' GLU . . . . . 0.463 ' HA ' ' CE1' ' A' ' 164' ' ' HIS . 25.6 tt0 -61.44 -40.21 93.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.169 177.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -71.87 -23.25 61.48 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.749 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' LEU . . . . . 0.433 HD13 ' O ' ' A' ' 157' ' ' ALA . 5.0 mp -79.09 -40.54 30.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.191 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -84.95 -18.51 34.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.089 0.471 . . . . 0.0 110.631 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 40.9 m80 64.29 14.91 9.07 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.227 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' HIS . . . . . 0.463 ' CE1' ' HA ' ' A' ' 159' ' ' GLU . 54.5 p-80 -73.39 126.83 31.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.044 0.449 . . . . 0.0 110.315 -177.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -97.67 158.25 15.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.566 -177.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -152.41 163.78 38.83 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.935 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -89.81 -38.65 13.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.681 0.277 . . . . 0.0 111.3 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.76 -179.604 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.405 ' HG3' ' O ' ' A' ' 1' ' ' MET . 22.6 ptt? . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 121.072 0.463 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -72.13 -34.67 7.87 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.877 2.385 . . . . 0.0 111.668 175.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -137.11 136.05 47.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.374 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -87.24 89.63 8.06 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.412 ' O ' HD13 ' A' ' 114' ' ' LEU . . . -92.43 -67.26 0.87 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.078 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.82 108.39 3.93 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -177.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -140.68 -6.7 1.13 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.917 179.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 48.7 mm -108.99 99.58 8.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.236 0.541 . . . . 0.0 110.632 -175.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -81.97 -35.46 28.97 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.571 177.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -172.73 120.94 0.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.078 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.541 HG21 ' HD2' ' A' ' 120' ' ' PRO . 5.7 m -72.0 135.43 27.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.051 0.453 . . . . 0.0 110.636 175.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.59 14.06 1.8 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.83 -176.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 69.77 159.54 0.19 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.468 0.707 . . . . 0.0 111.053 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 51.03 29.72 4.8 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.382 0.611 . . . . 0.0 110.99 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.4 m -86.87 124.28 32.92 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.281 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 56.3 mt -110.66 115.48 49.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 169.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.2 mt -89.81 106.16 16.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.233 0.539 . . . . 0.0 110.286 -176.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.6 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 8.0 t-20 -106.65 126.86 52.82 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.591 -177.871 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.455 ' O ' ' HG3' ' A' ' 125' ' ' GLU . 27.2 p90 -128.78 -175.15 3.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.912 -178.418 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -142.19 104.72 4.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.11 -177.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 79.7 p 53.92 -166.33 0.08 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.622 0.769 . . . . 0.0 112.207 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.712 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 0.2 OUTLIER -81.71 -59.45 2.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.998 0.428 . . . . 0.0 110.232 178.66 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t 59.26 -96.34 0.06 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.444 175.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -144.24 -67.91 0.33 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.016 0.436 . . . . 0.0 111.732 -175.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -81.05 -79.4 0.16 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -165.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -88.92 -1.76 58.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.192 0.52 . . . . 0.0 111.532 -171.188 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.712 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -66.82 -0.63 9.1 Favored Glycine 0 CA--C 1.52 0.387 0 CA-C-N 116.019 -0.537 . . . . 0.0 114.231 -175.199 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -50.68 -32.1 18.31 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 117.332 0.566 . . . . 0.0 111.96 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -72.58 -12.54 61.1 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 98.6 p -77.3 126.89 31.65 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.843 177.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -51.15 -23.18 3.03 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -175.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.49 ' CZ ' ' HB2' ' A' ' 71' ' ' PRO . 54.1 t80 -62.4 -62.38 1.79 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 174.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.605 ' HA ' HG21 ' A' ' 22' ' ' THR . . . 32.26 -149.7 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.272 1.029 . . . . 0.0 113.753 -176.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -166.24 66.2 0.11 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.407 177.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.503 ' O ' ' HA ' ' A' ' 46' ' ' THR . 94.6 m95 -131.1 121.65 18.83 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.629 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.52 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 19.2 Cg_endo -59.4 126.55 21.08 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.854 2.37 . . . . 0.0 112.515 178.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.2 pt -119.86 157.74 22.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.155 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -119.42 95.34 4.75 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -177.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 t -131.09 142.31 43.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.174 -0.467 . . . . 0.0 109.971 -176.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.8 t70 67.14 17.06 10.35 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.817 0.818 . . . . 0.0 109.58 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 72.19 22.23 78.94 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.353 -174.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.3 tppt? -121.82 149.92 42.64 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -176.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.7 m -94.95 113.51 25.23 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.872 0.368 . . . . 0.0 110.156 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.52 ' O ' ' HA ' ' A' ' 36' ' ' PRO . 41.6 m95 -109.89 123.47 36.17 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.455 ' O ' ' HB ' ' A' ' 46' ' ' THR . 39.8 Cg_exo -58.94 -11.9 13.65 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 123.053 2.502 . . . . 0.0 113.794 -177.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 35' ' ' TRP . 8.9 t 177.57 170.11 0.63 Allowed 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 174.649 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -40.59 88.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -175.172 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -48.17 -42.57 30.08 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.195 0.31 . . . . 0.0 111.785 176.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -64.64 -41.86 95.85 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.181 -176.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -69.95 -43.52 71.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.215 0.531 . . . . 0.0 110.179 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.444 ' HA ' HG11 ' A' ' 96' ' ' VAL . 89.5 t80 -61.26 -42.36 98.5 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.497 178.301 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.667 ' HG3' HD13 ' A' ' 65' ' ' ILE . 5.3 tp-100 -68.83 -45.56 70.84 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.885 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.487 ' HB1' ' CG ' ' A' ' 62' ' ' ARG . . . -65.9 -47.43 74.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.762 -177.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -75.23 -13.69 60.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.569 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.526 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.9 ttmp? -59.23 -33.19 70.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.077 0.465 . . . . 0.0 110.532 171.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.546 ' CE1' ' HG3' ' A' ' 83' ' ' LYS . 56.9 m-85 -107.32 166.99 10.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.971 -176.522 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.741 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.5 pt? -115.08 11.37 16.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.043 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -97.15 123.22 40.85 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.225 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.15 -40.13 86.64 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.101 -173.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -60.21 -53.77 53.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.923 0.392 . . . . 0.0 110.348 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 65' ' ' ILE . 3.1 t80 -66.44 -32.81 74.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.592 -177.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.487 ' CG ' ' HB1' ' A' ' 53' ' ' ALA . 44.4 ttm-85 -60.6 -49.41 77.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.019 0.437 . . . . 0.0 110.313 178.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -78.4 -15.15 58.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.109 0.48 . . . . 0.0 110.354 -178.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -74.66 -40.31 61.51 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.667 HD13 ' HG3' ' A' ' 52' ' ' GLN . 72.0 mt -70.39 -25.81 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.124 174.669 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.07 -22.06 53.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.854 174.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 73.4 ttt-85 -80.99 -29.97 35.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.958 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.511 HG21 ' HB ' ' A' ' 73' ' ' VAL . 14.9 p -75.8 126.61 36.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.235 0.54 . . . . 0.0 110.736 -179.005 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m -74.44 -41.75 60.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.506 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.466 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 30.2 t -69.09 130.05 91.63 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.069 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.49 ' HB2' ' CZ ' ' A' ' 32' ' ' PHE . 7.2 Cg_exo -73.45 -26.07 14.6 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.592 2.194 . . . . 0.0 111.322 174.203 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.5 tpt -70.44 -43.27 70.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.321 -177.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.511 ' HB ' HG21 ' A' ' 68' ' ' VAL . 59.8 t -63.84 -34.09 66.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.048 177.366 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.14 -49.53 74.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.472 177.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.542 ' HA ' HE21 ' A' ' 52' ' ' GLN . . . -60.16 -37.42 80.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.551 177.459 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -62.08 -33.93 75.34 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.758 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.522 ' SD ' HG12 ' A' ' 65' ' ' ILE . 56.1 mtt -65.72 -50.69 63.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.131 0.491 . . . . 0.0 111.473 -179.675 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.608 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -94.3 4.42 70.32 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.29 -0.957 . . . . 0.0 113.568 -174.186 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 5.3 tpp180 -71.24 -25.13 62.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.908 0.354 . . . . 0.0 111.211 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -99.37 131.97 45.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.152 0.501 . . . . 0.0 109.701 177.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.5 mtm180 -101.35 29.88 4.52 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.397 -172.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.4 p -82.7 19.73 1.27 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.574 0.702 . . . . 0.0 109.935 174.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.546 ' HG3' ' CE1' ' A' ' 56' ' ' PHE . 41.1 mmtm -89.22 169.72 12.36 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.703 178.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 16.8 Cg_endo -60.14 -29.13 88.42 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.332 2.021 . . . . 0.0 111.537 170.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.7 mt 67.72 -174.06 0.19 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.129 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.467 ' HB3' ' HB2' ' A' ' 89' ' ' TRP . 57.0 ttt-85 -134.18 142.27 47.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.811 -176.201 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -64.37 -68.41 0.36 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.799 -175.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -81.96 25.94 0.54 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.411 -174.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.489 ' CZ2' ' HE3' ' A' ' 55' ' ' LYS . 58.5 t-105 -61.0 -33.11 72.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.117 0.484 . . . . 0.0 110.104 177.294 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.415 ' O ' ' HE3' ' A' ' 93' ' ' LYS . 40.3 tt0 -55.92 -35.78 66.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.071 -178.371 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.1 p -99.93 -8.52 23.88 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -173.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.487 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.7 m -108.74 1.81 9.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -175.417 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.487 ' HB2' ' HZ2' ' A' ' 93' ' ' LYS . 10.0 mtmp? -54.92 -57.69 10.63 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.593 0.711 . . . . 0.0 110.49 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.543 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 1.9 pm0 -78.14 -14.94 59.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.134 -178.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.551 ' O ' ' HD3' ' A' ' 99' ' ' LYS . 34.0 tt0 -73.11 -52.37 14.5 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 176.488 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.444 HG11 ' HA ' ' A' ' 51' ' ' PHE . 96.8 t -58.44 -41.41 81.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.996 177.121 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 mmt -60.46 -39.0 86.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.281 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 38.1 ttm-85 -61.56 -38.45 87.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.524 0.202 . . . . 0.0 111.105 -178.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.551 ' HD3' ' O ' ' A' ' 95' ' ' GLN . 0.3 OUTLIER -71.03 -48.17 54.46 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.916 0.388 . . . . 0.0 110.805 176.23 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.2 -42.86 99.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.466 -177.269 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.6 -38.56 84.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.182 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 52.1 ttt180 -63.3 -48.17 79.2 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.06 178.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 107' ' ' GLN . . . -59.02 -38.01 78.26 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.981 0.419 . . . . 0.0 110.408 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.436 ' HZ3' HD13 ' A' ' 111' ' ' LEU . 60.4 tttm -62.11 -52.37 64.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.323 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.517 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 68.5 m-85 -81.96 -41.66 20.49 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -174.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -75.42 -39.59 58.76 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 121.969 -0.457 . . . . 0.0 111.197 -173.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.414 ' HB3' ' O ' ' A' ' 103' ' ' ALA . 29.4 tt0 -74.63 -31.19 61.91 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.796 0.331 . . . . 0.0 110.662 -178.238 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -100.21 97.55 8.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.31 66.04 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -171.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.472 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.7 pm0 -68.14 -32.45 72.74 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.038 -178.723 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.436 HD13 ' HZ3' ' A' ' 104' ' ' LYS . 42.4 mt -74.34 -37.15 63.61 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.584 ' HG3' HD13 ' A' ' 156' ' ' LEU . 24.5 ttm180 -58.23 -50.26 74.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.121 177.04 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.95 -39.88 95.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.724 -179.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.412 HD13 ' O ' ' A' ' 5' ' ' ALA . 58.6 tp -59.46 -48.83 80.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.583 177.267 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 44.1 tp -62.93 -39.61 95.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.993 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.423 HD21 ' HB2' ' A' ' 156' ' ' LEU . 80.5 mt -76.61 -15.03 59.94 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -82.97 -18.18 40.84 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.71 0.291 . . . . 0.0 111.159 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 66.2 p -72.44 -35.01 68.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.031 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.66 138.47 16.87 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.793 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.541 ' HD2' HG21 ' A' ' 11' ' ' VAL . 43.1 Cg_endo -95.72 29.16 15.96 Favored 'Cis proline' 0 CA--C 1.533 0.458 0 C-N-CA 124.147 -1.189 . . . . 0.0 113.657 1.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.19 153.32 43.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.88 0.372 . . . . 0.0 111.354 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -92.29 134.81 34.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.261 -177.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 40.1 mt -98.5 109.45 22.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.88 0.372 . . . . 0.0 110.708 -177.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.6 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 91.2 t -139.41 122.72 18.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.447 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 19' ' ' PHE . 87.6 tt0 -101.31 118.19 36.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.088 0.47 . . . . 0.0 110.77 176.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.79 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 57.4 t60 -89.92 81.76 6.25 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 173.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 14.5 t -120.86 143.52 48.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.304 -178.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -118.56 9.03 12.14 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.403 0.62 . . . . 0.0 109.808 175.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -62.24 -33.33 74.38 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.468 176.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -155.52 119.0 4.41 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.472 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -80.73 85.51 6.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.225 0.536 . . . . 0.0 110.787 -175.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.666 ' HA ' ' O ' ' A' ' 141' ' ' GLY . 40.2 t80 179.01 153.03 0.38 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.559 -1.2 . . . . 0.0 107.911 173.144 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.645 ' O ' ' HB3' ' A' ' 145' ' ' LEU . 84.1 m95 78.73 -19.19 0.46 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.557 0.743 . . . . 0.0 111.537 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' A' ' 143' ' ' ASN . . . -138.04 -152.82 6.12 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.373 -174.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.79 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 20.4 t70 -67.46 -24.86 65.65 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.156 0.503 . . . . 0.0 110.802 178.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.536 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 72.51 8.32 71.09 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.506 178.357 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 88.17 -10.66 70.13 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.408 -0.425 . . . . 0.0 113.103 178.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' HIS . . . . . 0.605 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 24.9 p80 -160.63 30.12 0.16 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.928 0.364 . . . . 0.0 111.625 -173.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 84.35 -51.37 4.55 Favored Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.813 -0.708 . . . . 0.0 113.191 177.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.605 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 53.1 mttp -75.49 55.4 0.81 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.073 0.463 . . . . 0.0 111.676 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.666 ' O ' ' HA ' ' A' ' 132' ' ' TYR . . . -123.7 -4.84 7.91 Favored Glycine 0 C--O 1.223 -0.576 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.0 176.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.405 ' C ' ' H ' ' A' ' 144' ' ' ARG . 2.9 mptp? 61.4 84.2 0.14 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.962 0.381 . . . . 0.0 111.722 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.437 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 8.0 t30 -68.08 5.73 0.87 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.412 1.085 . . . . 0.0 111.597 -178.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.405 ' H ' ' C ' ' A' ' 142' ' ' LYS . 14.0 tpt180 -33.06 -31.05 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.542 1.137 . . . . 0.0 113.276 176.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.645 ' HB3' ' O ' ' A' ' 133' ' ' TRP . 25.5 tp -68.23 -49.23 62.12 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 117.944 0.338 . . . . 0.0 110.957 -179.268 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -61.47 -32.54 81.51 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.251 -0.74 . . . . 0.0 111.251 177.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -69.01 -43.25 75.17 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 175.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.5 -48.79 76.44 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.439 175.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.82 -42.08 88.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.892 178.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 73.1 mtm -69.04 -37.46 78.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.331 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -60.57 -51.63 68.59 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.705 0.288 . . . . 0.0 110.253 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 64.3 tp -60.11 -43.07 95.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.416 178.61 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.441 HH21 ' HA ' ' A' ' 120' ' ' PRO . 2.4 ttt-85 -51.85 -56.95 10.92 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.676 177.352 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.472 ' O ' HG13 ' A' ' 158' ' ' ILE . 35.8 mt-10 -72.86 -22.98 60.69 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.213 -178.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -68.57 -39.14 81.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.222 174.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.584 HD13 ' HG3' ' A' ' 112' ' ' ARG . 96.0 mt -67.93 -31.25 70.87 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.108 0.48 . . . . 0.0 109.892 179.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.575 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -67.38 -46.08 74.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.34 175.067 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 154' ' ' GLU . 85.2 mt -65.72 -34.39 70.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -59.67 -34.35 72.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.303 0.573 . . . . 0.0 109.943 175.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -79.14 -18.81 52.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.667 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' LEU . . . . . 0.575 HD13 ' O ' ' A' ' 157' ' ' ALA . 6.1 mp -78.43 -25.06 45.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.114 0.483 . . . . 0.0 110.619 176.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -84.07 11.26 8.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.324 178.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 9.6 m80 -61.49 93.68 0.04 OUTLIER 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 173.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -103.69 41.21 1.31 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.223 0.535 . . . . 0.0 110.217 -174.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.447 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 49.3 t-80 -77.91 14.93 0.97 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.666 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.447 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 11.9 m170 68.35 -172.16 0.19 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.317 0.579 . . . . 0.0 110.888 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -145.19 103.88 3.9 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.123 173.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 . . . . . 0 C--O 1.245 0.856 0 CA-C-O 118.343 -0.837 . . . . 0.0 109.586 -173.635 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.4 t . . . . . 0 N--CA 1.455 -0.201 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -131.12 153.83 48.96 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.657 -176.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.51 136.15 42.2 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 163.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.7 mm-40 . . . . . 0 N--CA 1.466 0.338 0 O-C-N 123.656 0.597 . . . . 0.0 110.538 -173.757 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.6 t60 . . . . . 0 CA--C 1.528 0.123 0 CA-C-O 120.77 0.319 . . . . 0.0 110.432 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -61.53 168.85 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 111.09 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.456 ' O ' ' HB2' ' A' ' 13' ' ' GLN . 4.5 mtt -64.09 -85.5 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.215 -174.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' MET . 8.8 tt0 169.89 120.49 0.01 OUTLIER 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.759 -177.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 65.03 26.16 12.62 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.24 0.543 . . . . 0.0 110.509 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.47 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 29.3 m -76.87 110.97 11.92 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.299 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.9 mm -77.35 108.36 10.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.9 mt -95.82 99.32 9.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.764 -177.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.75 106.67 18.67 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 173.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -117.47 132.8 56.49 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.036 -175.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -150.48 100.36 2.86 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.773 167.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.409 ' HB3' ' OD2' ' A' ' 24' ' ' ASP . 6.9 m 177.89 88.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 O-C-N 124.065 0.853 . . . . 0.0 109.458 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.701 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 1.3 m -79.87 2.63 22.55 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.994 0.426 . . . . 0.0 111.473 -174.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.1 m -91.42 -8.32 48.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.706 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.409 ' OD2' ' HB3' ' A' ' 21' ' ' SER . 4.1 p30 -131.18 -165.5 1.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.305 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -65.7 -26.46 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.364 -172.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -80.38 -2.49 45.75 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.92 0.39 . . . . 0.0 111.034 177.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.701 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -83.26 -16.84 68.19 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.728 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -68.25 -26.64 65.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.071 0.462 . . . . 0.0 110.898 -179.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -69.28 -26.17 64.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.31 178.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.3 m -76.08 126.76 31.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 171.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -60.46 -20.71 60.85 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -76.51 4.71 8.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.116 0.484 . . . . 0.0 111.225 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -66.75 131.46 46.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.749 0.309 . . . . 0.0 110.678 176.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.499 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -80.93 58.83 3.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.198 0.523 . . . . 0.0 111.681 -175.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -102.34 117.64 60.66 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.822 174.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.6 125.14 17.8 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.956 2.438 . . . . 0.0 112.556 -176.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.757 HG22 ' HA ' ' A' ' 104' ' ' LYS . 29.5 pt -114.4 139.34 40.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.299 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -102.54 105.09 15.55 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.441 HG22 ' CB ' ' A' ' 103' ' ' ALA . 4.0 t -128.57 123.12 58.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.263 -173.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 59.21 27.21 16.16 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.191 174.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.61 -5.62 57.01 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.563 -0.827 . . . . 0.0 113.433 175.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.519 ' HD3' ' HD2' ' A' ' 66' ' ' ARG . 60.9 mttm -124.05 156.9 35.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 117.596 0.698 . . . . 0.0 111.373 -178.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.1 m -100.54 117.04 33.88 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.266 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.489 ' HB2' HG13 ' A' ' 37' ' ' ILE . 41.1 m95 -105.86 133.92 19.98 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.431 -179.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 43.8 Cg_exo -58.43 -41.27 67.17 Favored 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 122.66 2.24 . . . . 0.0 112.752 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.499 HG22 ' HA ' ' A' ' 34' ' ' ALA . 77.9 p -148.24 172.14 14.82 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -33.49 75.18 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -177.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.592 ' H ' ' CD ' ' A' ' 48' ' ' GLU . 3.6 mp0 -61.3 -28.55 69.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.947 0.403 . . . . 0.0 110.904 -177.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.419 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 57.1 m80 -65.91 -48.01 72.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.401 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -72.75 -35.99 67.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.335 0.588 . . . . 0.0 109.758 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -59.58 -49.1 79.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.028 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.434 ' HA ' ' CB ' ' A' ' 55' ' ' LYS . 37.2 mt-30 -85.97 -13.31 48.02 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.682 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.479 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -69.43 -30.43 68.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.26 0.552 . . . . 0.0 109.961 173.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -90.8 -21.76 21.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.649 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.434 ' CB ' ' HA ' ' A' ' 52' ' ' GLN . 83.0 tttt -58.12 -53.31 59.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.2 0.524 . . . . 0.0 110.606 176.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -91.56 142.05 28.05 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.75 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.759 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.4 pt? -98.5 10.13 41.62 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 173.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.4 ' HB2' ' HB3' ' A' ' 61' ' ' TYR . 33.7 m-20 -67.51 112.34 4.63 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.762 174.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -50.98 -61.82 1.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.022 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -77.16 -18.27 57.96 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.866 -171.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.543 ' O ' HG13 ' A' ' 65' ' ' ILE . 3.9 t80 -80.58 -35.64 33.95 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.479 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 33.5 ttm180 -59.21 -44.44 92.26 Favored 'General case' 0 CA--C 1.521 -0.144 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 173.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.42 -39.72 76.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.495 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.441 ' CD ' HH21 ' A' ' 67' ' ' ARG . 7.8 tp10 -63.0 -49.24 75.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.916 0.389 . . . . 0.0 110.682 177.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.543 HG13 ' O ' ' A' ' 61' ' ' TYR . 3.5 mt -70.19 -22.78 24.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.185 0.517 . . . . 0.0 110.877 -177.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.519 ' HD2' ' HD3' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -78.46 -29.27 46.77 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.211 176.891 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.441 HH21 ' CD ' ' A' ' 64' ' ' GLU . 56.5 ttp180 -86.02 -35.44 20.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.638 -175.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.4 p -65.43 117.4 6.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.474 0.654 . . . . 0.0 111.22 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.2 m -77.14 -33.72 56.66 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.593 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.3 m -66.24 126.55 92.2 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.335 -178.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.419 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 54.4 Cg_endo -71.86 -40.64 2.56 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.828 2.352 . . . . 0.0 113.281 -179.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 87.0 mtp -70.29 -29.8 66.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.745 0.307 . . . . 0.0 110.74 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.519 ' O ' ' HG3' ' A' ' 77' ' ' MET . 99.6 t -66.74 -39.51 83.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.558 178.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.36 -39.36 90.33 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 120.92 0.391 . . . . 0.0 110.369 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.64 -38.27 80.34 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.711 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -65.97 -57.36 8.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.954 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -83.26 -13.04 56.08 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.319 -0.553 . . . . 0.0 111.159 -176.58 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.34 -10.33 60.87 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.644 -0.788 . . . . 0.0 111.607 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.72 -40.46 66.09 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 122.742 0.417 . . . . 0.0 111.647 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.456 ' OD2' ' HG3' ' A' ' 83' ' ' LYS . 30.3 t70 -59.73 137.47 58.03 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.015 -170.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 87.1 mtm-85 -116.96 18.54 14.67 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.059 176.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.4 m -90.91 -28.96 17.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.663 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.456 ' HG3' ' OD2' ' A' ' 80' ' ' ASP . 6.1 mtpm? -63.31 156.69 68.26 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.257 176.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.05 113.62 1.66 Allowed 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.43 2.087 . . . . 0.0 111.786 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 67.0 mt -101.04 163.75 12.14 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.485 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.443 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 23.6 mtp180 -67.26 139.27 57.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.842 0.353 . . . . 0.0 110.446 176.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 43.2 mtpt -60.64 -28.41 68.54 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.495 0.664 . . . . 0.0 110.604 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -104.07 12.96 33.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.413 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.493 ' HA ' HG22 ' A' ' 92' ' ' VAL . 50.3 t-105 -59.98 -33.65 72.24 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.534 -176.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.66 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 18.3 mm-40 -65.65 -24.32 67.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.398 -179.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.3 t -99.68 -44.78 5.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.299 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.7 m -73.96 3.01 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -170.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.66 ' NZ ' ' HA ' ' A' ' 90' ' ' GLU . 56.7 mttp -56.79 -42.35 79.32 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 175.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.498 ' O ' ' HB2' ' A' ' 98' ' ' ARG . 52.1 mt-10 -61.13 -39.5 90.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.833 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -69.19 -50.88 43.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.368 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 59.6 t -63.78 -49.37 82.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.776 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.498 ' SD ' HD13 ' A' ' 145' ' ' LEU . 50.7 ttm -66.2 -36.06 82.08 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.335 -177.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' A' ' 94' ' ' GLU . 20.3 ttt180 -61.31 -43.16 99.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.832 0.349 . . . . 0.0 110.664 -179.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -70.51 -35.34 73.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.572 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.88 88.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.732 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.468 HD11 HD12 ' A' ' 145' ' ' LEU . 94.0 mt -64.46 -40.3 95.44 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.53 176.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.497 ' O ' ' HB2' ' A' ' 106' ' ' GLU . 34.2 ttm180 -54.17 -54.46 39.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.1 175.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.441 ' CB ' HG22 ' A' ' 39' ' ' VAL . . . -62.05 -34.43 76.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.457 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.757 ' HA ' HG22 ' A' ' 37' ' ' ILE . 64.4 tttm -63.96 -56.1 17.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.249 -178.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.497 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 71.2 m-85 -78.38 -28.0 46.96 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -175.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -79.02 -40.58 31.04 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.09 -177.464 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -69.61 -14.67 62.95 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.05 0.452 . . . . 0.0 110.884 -176.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -124.98 105.97 9.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.359 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -56.67 -31.43 64.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.96 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.05 -47.41 81.03 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.964 177.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 36.0 mt -74.49 -39.85 62.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.763 -175.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.589 ' HG3' HD13 ' A' ' 156' ' ' LEU . 61.9 ttt180 -59.12 -48.45 81.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.451 178.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.8 -35.14 80.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.553 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 62.2 tp -64.61 -37.15 86.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.61 176.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.471 ' HG ' ' HB2' ' A' ' 153' ' ' ARG . 16.5 tp -64.02 -50.52 68.14 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.099 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.506 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 4.6 mp -67.44 -19.71 65.4 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.82 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -67.67 -30.15 69.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.511 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.445 ' HB ' HD21 ' A' ' 123' ' ' LEU . 70.0 p -81.3 -0.46 41.06 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 120.758 0.313 . . . . 0.0 111.683 -177.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.541 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -86.33 139.94 34.17 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 170.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.433 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 73.7 Cg_endo -99.11 74.67 0.14 OUTLIER 'Cis proline' 0 N--CA 1.454 -0.799 0 C-N-CA 124.468 -1.055 . . . . 0.0 113.291 -0.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.47 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -111.0 176.4 5.04 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -120.83 120.53 35.83 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.996 0.426 . . . . 0.0 110.272 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.445 HD21 ' HB ' ' A' ' 118' ' ' THR . 9.1 mt -86.32 125.85 33.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.787 -173.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.2 t -130.83 116.85 35.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.845 0.355 . . . . 0.0 110.925 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -79.99 130.48 35.31 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 175.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.633 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 10.6 t60 -125.64 77.47 1.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.188 0.518 . . . . 0.0 109.613 -173.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 5.0 t -87.2 114.23 23.63 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.543 0.687 . . . . 0.0 109.319 175.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.711 ' OE2' ' HA3' ' A' ' 137' ' ' GLY . 5.6 tp10 -82.17 41.32 0.67 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.616 0.722 . . . . 0.0 109.378 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -143.06 -75.79 0.26 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.375 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -118.42 95.35 4.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.068 -174.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.35 86.08 2.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.165 -177.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.448 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 28.7 t80 -151.08 122.06 7.65 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.606 ' O ' ' HB3' ' A' ' 145' ' ' LEU . 71.3 m95 74.73 -10.34 1.2 Allowed 'General case' 0 N--CA 1.474 0.737 0 O-C-N 124.016 0.823 . . . . 0.0 110.585 -171.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.569 ' O ' ' HA3' ' A' ' 141' ' ' GLY . . . -137.79 136.99 8.54 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 108.196 -1.962 . . . . 0.0 108.196 176.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.561 ' HB2' ' HB2' ' A' ' 143' ' ' ASN . 1.4 t70 -68.82 1.77 3.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.697 0.749 . . . . 0.0 112.109 -166.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 68.85 -164.53 49.32 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.933 175.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.711 ' HA3' ' OE2' ' A' ' 128' ' ' GLU . . . -89.98 -17.02 55.13 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.924 178.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -99.63 -16.92 18.05 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 89.08 62.07 1.38 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.118 -1.039 . . . . 0.0 112.468 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 56.4 tttm 176.84 65.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 176.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.569 ' HA3' ' O ' ' A' ' 134' ' ' GLY . . . -124.67 4.62 8.61 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.176 -1.012 . . . . 0.0 113.441 -173.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.438 ' C ' ' H ' ' A' ' 144' ' ' ARG . 55.0 mttp 64.19 53.71 1.73 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.122 0.486 . . . . 0.0 109.895 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.561 ' HB2' ' HB2' ' A' ' 135' ' ' ASP . 7.4 t30 -57.15 5.1 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.368 1.467 . . . . 0.0 113.791 -177.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.533 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 57.9 mtm180 -51.84 -13.28 0.26 Allowed 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.606 ' HB3' ' O ' ' A' ' 133' ' ' TRP . 25.4 tp -60.57 -49.84 75.94 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 171.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.653 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -62.92 -33.03 85.98 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.555 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -68.82 -41.21 78.93 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 121.165 -0.214 . . . . 0.0 110.638 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 88.7 mt -58.05 -37.13 73.82 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.83 -38.07 89.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.914 175.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.653 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 38.5 mtt -66.35 -50.28 64.08 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.183 0.516 . . . . 0.0 110.189 178.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 23.0 tt0 -69.38 -35.95 76.31 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.608 -176.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 102' ' ' ARG . 50.9 tp -62.07 -43.92 97.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.041 0.448 . . . . 0.0 109.859 174.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.541 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 47.5 ttp85 -55.51 -41.54 73.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.969 176.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . 0.503 ' O ' HG13 ' A' ' 158' ' ' ILE . 31.6 tt0 -68.36 -34.71 76.57 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.684 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' ' 151' ' ' GLU . 15.3 mt-30 -65.35 -41.85 93.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.068 0.461 . . . . 0.0 109.858 176.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.589 HD13 ' HG3' ' A' ' 112' ' ' ARG . 94.3 mt -67.27 -28.88 68.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.086 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -69.44 -40.95 76.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.453 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 154' ' ' GLU . 76.2 mt -60.63 -46.06 96.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.669 0.271 . . . . 0.0 110.474 178.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . 0.49 ' CD ' HH22 ' A' ' 112' ' ' ARG . 0.2 OUTLIER -61.3 -38.45 86.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.07 0.462 . . . . 0.0 110.088 177.381 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -70.33 -33.31 71.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.477 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 4.6 mp -68.63 -10.62 57.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.132 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.426 174.988 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.779 HG22 ' H ' ' A' ' 5' ' ' ALA . 2.5 p . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.501 0.191 . . . . 0.0 110.926 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.68 ' H ' HG13 ' A' ' 3' ' ' VAL . 7.2 tpp85 56.84 25.73 10.73 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.74 0.781 . . . . 0.0 111.586 178.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.779 ' H ' HG22 ' A' ' 3' ' ' VAL . . . -69.32 127.87 34.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 173.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 . . . . . 0 C--N 1.324 -0.515 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.946 -176.145 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.8 p-80 . . . . . 0 CA--C 1.517 -0.292 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.728 HG21 ' HD2' ' A' ' 120' ' ' PRO . 34.1 m -93.74 175.19 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 174.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 51.4 mtm -108.95 37.22 2.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.312 -178.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.403 ' H ' HG23 ' A' ' 11' ' ' VAL . 52.2 tt0 63.83 102.56 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.952 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.3 t70 49.95 79.84 0.08 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.528 -175.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.8 m -103.66 127.41 51.1 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.713 -178.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 48.5 mt -96.67 107.13 19.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 CA-C-O 121.446 0.641 . . . . 0.0 110.074 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -89.89 96.96 6.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.24 -176.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.555 HD22 ' HB ' ' A' ' 124' ' ' VAL . 12.7 m120 -83.51 101.34 11.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.362 174.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.447 ' O ' ' HA ' ' A' ' 125' ' ' GLU . 52.5 p90 -116.19 148.93 39.89 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.781 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.44 ' HB2' ' HB3' ' A' ' 126' ' ' HIS . 34.9 t80 -150.23 150.3 31.38 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.388 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 96.1 p 62.48 159.52 0.07 Allowed 'General case' 0 C--O 1.231 0.113 0 O-C-N 124.867 1.354 . . . . 0.0 111.661 177.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.498 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 7.8 p -83.14 -65.99 0.94 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.528 175.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.1 t 61.41 -78.88 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.205 0 O-C-N 124.135 0.897 . . . . 0.0 111.625 176.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -105.9 -169.08 1.53 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.901 0.381 . . . . 0.0 110.117 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -66.02 -31.93 73.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.749 -174.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -75.99 -1.59 26.44 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.309 0.576 . . . . 0.0 111.187 -175.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.498 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -68.53 -0.32 16.93 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.109 174.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -52.36 -32.47 38.55 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.602 0.761 . . . . 0.0 112.642 -177.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -60.1 -36.49 77.53 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.7 t -59.97 148.86 33.74 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.133 0.492 . . . . 0.0 111.04 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -74.5 -14.64 60.84 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.096 0.474 . . . . 0.0 109.928 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -96.84 7.9 45.57 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.31 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.475 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -70.69 136.06 48.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.715 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -83.12 64.6 7.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.608 0.718 . . . . 0.0 110.939 -174.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.414 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 70.4 m95 -108.86 120.97 44.46 Favored Pre-proline 0 C--N 1.314 -0.957 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.048 172.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 34.5 Cg_exo -60.49 133.45 48.97 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.985 2.457 . . . . 0.0 112.518 -177.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.482 HD13 ' HA ' ' A' ' 47' ' ' SER . 39.0 pt -118.81 147.91 22.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.967 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -109.04 98.62 8.06 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.414 ' CG1' ' HE2' ' A' ' 99' ' ' LYS . 21.2 t -122.02 120.37 61.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.913 -174.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 61.57 27.8 17.19 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.593 0.558 . . . . 0.0 110.629 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.39 0.57 90.12 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 121.034 -0.603 . . . . 0.0 112.462 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -104.63 144.4 31.76 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -177.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.1 m -105.29 109.07 20.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.924 0.392 . . . . 0.0 110.674 -175.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.41 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 62.4 m95 -102.05 143.84 27.41 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.713 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 32.4 Cg_exo -59.24 -30.48 93.07 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.939 2.426 . . . . 0.0 112.248 179.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.748 HG23 ' OE1' ' A' ' 48' ' ' GLU . 2.3 t -170.76 -179.93 3.01 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.882 177.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.482 ' HA ' HD13 ' A' ' 37' ' ' ILE . 20.3 m -66.62 -39.62 88.41 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 113.369 0.878 . . . . 0.0 113.369 -166.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.748 ' OE1' HG23 ' A' ' 46' ' ' THR . 0.6 OUTLIER -63.15 -33.99 76.65 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.498 -171.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -56.01 -42.99 77.3 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.609 0.242 . . . . 0.0 111.072 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -71.46 -39.63 70.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.99 0.424 . . . . 0.0 110.24 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -60.63 -38.37 84.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.151 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.1 mm100 -72.87 -46.47 52.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.424 177.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.657 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -61.4 -42.18 98.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.705 -179.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -84.8 -13.66 50.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.764 -176.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.591 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.8 ttmp? -64.35 -53.14 53.31 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.86 0.362 . . . . 0.0 110.612 173.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.444 ' HE1' ' HB2' ' A' ' 83' ' ' LYS . 92.9 m-85 -80.66 160.22 25.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.12 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.494 HD11 ' HB3' ' A' ' 86' ' ' ARG . 5.5 mp -98.89 -28.84 13.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.645 177.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -58.85 120.57 9.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.06 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -68.72 -37.45 79.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -61.27 -42.74 99.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.417 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.423 ' O ' HG13 ' A' ' 65' ' ' ILE . 0.2 OUTLIER -74.14 -37.28 64.09 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.68 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.657 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.5 ttm180 -62.58 -41.56 99.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.397 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.522 ' HG2' ' NH1' ' A' ' 67' ' ' ARG . 16.5 tt0 -71.04 -26.93 63.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.025 178.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -68.09 -40.46 82.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.851 175.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.516 HG12 ' SD ' ' A' ' 77' ' ' MET . 56.6 mt -71.89 -18.52 19.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.283 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -75.38 -24.65 57.27 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.522 ' NH1' ' HG2' ' A' ' 63' ' ' GLU . 35.8 mmt-85 -73.37 -36.08 66.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.999 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.467 HG21 ' HB ' ' A' ' 73' ' ' VAL . 14.9 p -75.39 125.39 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.638 0.733 . . . . 0.0 112.038 -171.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.2 p -91.4 -38.78 12.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.392 176.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 20.0 m -72.57 121.04 83.84 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.513 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -52.52 -46.29 34.23 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.658 2.906 . . . . 0.0 113.519 179.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 85.1 mtp -63.81 -31.36 72.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.322 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.467 ' HB ' HG21 ' A' ' 68' ' ' VAL . 43.2 t -75.98 -32.29 23.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.808 0.337 . . . . 0.0 110.244 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.62 99.51 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.265 0.555 . . . . 0.0 110.462 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.23 -39.51 86.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.09 175.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -34.62 72.03 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.899 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.516 ' SD ' HG12 ' A' ' 65' ' ' ILE . 64.2 mtt -64.73 -55.04 22.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.061 0.458 . . . . 0.0 110.653 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.22 11.59 60.37 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.047 -0.597 . . . . 0.0 113.007 -176.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.54 -15.73 63.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.074 0.464 . . . . 0.0 110.372 174.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -107.18 114.03 27.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.439 177.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.638 ' HB2' HD11 ' A' ' 85' ' ' LEU . 26.1 ptt180 -101.16 24.93 8.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.783 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.4 m -81.08 -9.96 59.74 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.662 0.744 . . . . 0.0 109.223 174.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.444 ' HB2' ' HE1' ' A' ' 56' ' ' PHE . 46.8 mmtm -80.59 166.29 40.5 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.864 177.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -56.31 108.36 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.466 2.111 . . . . 0.0 113.126 -177.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.638 HD11 ' HB2' ' A' ' 81' ' ' ARG . 92.7 mt -91.8 148.85 21.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.824 175.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.494 ' HB3' HD11 ' A' ' 57' ' ' LEU . 11.6 ptp180 -84.26 150.01 25.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.04 0.448 . . . . 0.0 111.519 -175.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -75.27 -25.45 58.02 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.997 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -90.92 9.94 28.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.835 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.447 ' HB2' ' HG3' ' A' ' 86' ' ' ARG . 58.0 t-105 -56.27 -47.6 78.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.756 -174.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.4 -16.52 64.15 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -177.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.4 m -99.6 -30.45 12.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.89 0.376 . . . . 0.0 111.285 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 29.7 m -93.0 -0.08 10.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.668 0.27 . . . . 0.0 110.7 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -55.39 -57.95 9.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.195 0.522 . . . . 0.0 110.554 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -64.63 -40.62 95.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.984 177.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.49 -53.65 48.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.566 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 45.1 t -60.18 -49.27 84.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.072 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.1 tpt -65.94 -38.91 89.83 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.908 -174.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.511 ' HD3' HD22 ' A' ' 148' ' ' LEU . 31.8 mtm180 -73.5 -22.63 60.09 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.444 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.414 ' HE2' ' CG1' ' A' ' 39' ' ' VAL . 86.9 tttt -72.97 -38.37 66.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.015 0.436 . . . . 0.0 109.858 176.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.77 -42.38 67.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.473 176.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.459 HD22 HD21 ' A' ' 149' ' ' LEU . 61.7 mt -63.13 -42.98 99.6 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.008 177.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 102' ' ' ARG . 40.7 ttm180 -52.35 -53.0 50.3 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.768 175.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.422 ' CB ' ' HB ' ' A' ' 37' ' ' ILE . . . -55.36 -43.62 75.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.002 -176.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -63.0 -52.14 64.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.685 0.279 . . . . 0.0 111.013 -176.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -77.37 -28.59 52.93 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -79.64 -46.21 17.62 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 122.248 -0.282 . . . . 0.0 111.15 -175.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -66.58 -38.95 88.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.88 0.371 . . . . 0.0 110.767 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -101.96 100.27 10.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.437 178.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.406 ' HA ' ' HB2' ' A' ' 112' ' ' ARG . . . -61.92 -22.64 65.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.106 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.8 mp0 -56.48 -49.58 74.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.909 175.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 51.3 mt -74.71 -33.93 62.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.953 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 109' ' ' ALA . 15.4 ttt180 -54.35 -51.14 65.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.274 177.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.7 -36.61 80.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.873 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.3 tp -65.23 -41.01 94.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.579 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.739 ' HG ' ' HB2' ' A' ' 153' ' ' ARG . 47.2 tp -63.78 -33.65 76.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.539 177.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.3 mt -81.19 -14.98 57.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.148 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.91 -30.51 21.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.182 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 18.1 p -72.36 -25.92 61.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.152 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.417 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -40.67 132.62 1.75 Allowed Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.147 173.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.728 ' HD2' HG21 ' A' ' 11' ' ' VAL . 28.2 Cg_endo -101.15 31.27 10.14 Favored 'Cis proline' 0 N--CA 1.459 -0.528 0 C-N-CA 124.702 -0.957 . . . . 0.0 112.807 -1.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -60.01 141.84 54.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.902 0.382 . . . . 0.0 111.658 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.512 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 17.3 ttpt -84.62 113.89 21.59 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.98 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 41.5 mt -81.47 116.88 21.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.776 -175.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.555 ' HB ' HD22 ' A' ' 18' ' ' ASN . 89.1 t -128.88 116.72 42.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.732 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.447 ' HA ' ' O ' ' A' ' 19' ' ' PHE . 37.0 tt0 -88.13 128.39 35.43 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.496 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 8.0 t60 -97.05 77.2 2.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.488 0.661 . . . . 0.0 110.223 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.4 m -104.49 101.02 10.7 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.94 -177.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.411 ' HG3' ' HA3' ' A' ' 137' ' ' GLY . 34.9 tt0 -84.98 -43.48 13.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.556 -173.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -62.68 -52.88 61.55 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -103.68 100.56 10.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.519 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.498 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -77.74 85.52 4.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.967 0.413 . . . . 0.0 110.391 178.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.405 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 5.4 t80 -170.03 118.79 0.59 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.698 ' HB3' HD22 ' A' ' 145' ' ' LEU . 3.7 m95 71.37 10.6 6.64 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.782 0.676 . . . . 0.0 111.571 -178.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -136.45 -153.89 6.65 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.389 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.496 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 2.1 p-10 -91.52 -13.54 31.95 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.345 0.593 . . . . 0.0 109.846 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . 0.498 ' HA2' ' HA ' ' A' ' 131' ' ' ALA . . . 77.06 -0.15 67.99 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.171 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.411 ' HA3' ' HG3' ' A' ' 128' ' ' GLU . . . 81.25 15.93 75.48 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.361 -0.447 . . . . 0.0 112.719 -177.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -168.1 -24.79 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -177.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 141.49 -49.65 0.76 Allowed Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.256 -0.973 . . . . 0.0 112.499 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -82.94 62.76 6.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.33 0.586 . . . . 0.0 110.126 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.18 8.62 9.03 Favored Glycine 0 C--N 1.315 -0.616 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.787 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 49.9 mttp 62.48 63.67 1.0 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 122.509 0.323 . . . . 0.0 111.228 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.427 ' OD1' HG13 ' A' ' 124' ' ' VAL . 6.4 t30 -72.66 5.16 3.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.96 0.41 . . . . 0.0 111.304 -177.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.636 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 44.7 ttm180 -47.6 -25.91 1.3 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.761 177.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.698 HD22 ' HB3' ' A' ' 133' ' ' TRP . 20.4 tp -53.9 -47.17 71.43 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.857 0.36 . . . . 0.0 110.391 175.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -62.93 -36.05 92.89 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.96 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . 0.435 ' HA ' ' HE3' ' A' ' 150' ' ' MET . 86.4 t80 -67.08 -41.3 86.57 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 176.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 82.1 mt -61.1 -40.23 92.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.235 -0.439 . . . . 0.0 109.93 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.459 HD21 HD22 ' A' ' 101' ' ' LEU . 96.1 mt -60.06 -46.86 88.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.53 174.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.512 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 74.2 mtm -67.5 -39.54 85.17 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.798 -178.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -70.71 -35.62 72.84 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.542 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 54.9 tp -61.95 -45.77 92.24 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 173.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.739 ' HB2' ' HG ' ' A' ' 115' ' ' LEU . 0.6 OUTLIER -52.01 -42.46 63.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.877 175.461 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -62.03 -38.24 87.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.732 -177.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -73.48 -38.72 65.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.845 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 41.0 mt -67.09 -23.28 65.83 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.084 0.468 . . . . 0.0 110.715 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.32 72.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.218 173.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.56 -33.54 64.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.699 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.25 -49.65 63.63 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.36 0.6 . . . . 0.0 110.97 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 13.7 mttp -87.06 -20.83 26.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.296 -176.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 11.5 tp -63.7 -27.9 69.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.34 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 . . . . . 0 C--N 1.331 -0.197 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.803 179.993 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.452 -0.337 0 N-CA-C 110.564 -0.162 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 65.89 -81.13 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.957 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 61.1 90.77 0.06 Allowed 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.946 0.779 . . . . 0.0 111.919 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.494 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 12.5 mm-40 . . . . . 0 C--N 1.324 -0.517 0 CA-C-O 121.336 0.589 . . . . 0.0 111.127 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 N--CA 1.468 0.473 0 CA-C-O 121.18 0.514 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.484 HG11 ' HB2' ' A' ' 121' ' ' ALA . 28.3 m -129.25 -174.41 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.631 173.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.2 mmt -93.71 -74.26 0.54 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.17 0.509 . . . . 0.0 110.463 -173.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -176.48 121.83 0.15 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.929 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.6 t70 54.33 39.95 31.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.792 0.806 . . . . 0.0 110.055 -176.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.4 m -76.31 140.66 41.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.139 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.434 HG12 ' HB3' ' A' ' 122' ' ' LYS . 61.2 mt -115.62 121.51 67.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.4 mt -103.88 111.0 31.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.001 -175.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.611 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 8.5 m120 -87.88 101.34 13.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.968 173.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.511 ' CD1' ' HB2' ' A' ' 29' ' ' PHE . 42.6 p90 -101.24 128.54 47.31 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.996 0.426 . . . . 0.0 110.962 -178.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -150.57 -179.19 7.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 173.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.0 m 71.3 84.82 0.13 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.638 0.732 . . . . 0.0 110.658 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.92 -9.82 58.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.233 -175.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.5 m -99.4 3.02 45.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.737 0.304 . . . . 0.0 110.855 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -93.35 -84.83 0.29 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.339 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -171.81 -46.6 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.595 0.236 . . . . 0.0 111.072 174.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -84.18 -4.8 59.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.366 0.603 . . . . 0.0 110.605 -174.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -79.13 -0.3 82.17 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.734 -0.667 . . . . 0.0 112.274 177.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -51.28 -33.5 28.88 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -177.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.511 ' HB2' ' CD1' ' A' ' 19' ' ' PHE . 89.0 m-85 -56.98 -19.07 16.12 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -176.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.3 t -75.45 147.71 39.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.197 0.522 . . . . 0.0 110.45 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -73.27 -10.03 59.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.214 -176.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -90.15 8.35 33.36 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.408 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.35 139.22 55.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.163 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.539 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -82.67 57.35 3.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.599 -176.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.447 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 76.1 m95 -118.32 115.92 35.74 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.493 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 35' ' ' TRP . 19.4 Cg_endo -60.48 136.61 68.68 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.996 2.464 . . . . 0.0 112.386 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.561 HG22 ' HA ' ' A' ' 104' ' ' LYS . 24.4 pt -123.8 176.43 5.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.053 -178.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 42.2 tptt -131.4 100.37 5.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.3 t -119.01 130.06 74.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.936 -174.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 62.8 9.52 3.69 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 124.044 0.84 . . . . 0.0 111.362 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.94 4.02 42.11 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.82 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -120.21 146.17 46.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 117.188 0.494 . . . . 0.0 110.952 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.1 m -79.17 131.67 36.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.303 176.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.443 ' HB2' HG13 ' A' ' 37' ' ' ILE . 86.8 m95 -122.46 137.26 27.48 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 176.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.44 -36.55 98.76 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.672 2.248 . . . . 0.0 112.437 -178.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.539 HG22 ' HA ' ' A' ' 34' ' ' ALA . 81.0 p -148.18 174.16 12.26 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.3 m -72.85 -28.42 62.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.307 0.575 . . . . 0.0 109.913 174.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -68.47 -36.09 78.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.256 -179.706 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.405 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 34.4 m80 -62.37 -36.39 82.12 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.407 0.146 . . . . 0.0 111.31 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -72.57 -37.85 68.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.014 0.435 . . . . 0.0 109.952 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -62.42 -47.62 83.28 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.726 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.574 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 64.6 mm-40 -64.72 -44.88 88.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.363 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.437 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -60.41 -36.54 78.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.305 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -71.26 -29.4 65.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.573 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.606 ' HE3' HD21 ' A' ' 85' ' ' LEU . 75.3 tttt -65.37 -43.64 90.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.787 176.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.728 ' HE1' ' HG3' ' A' ' 83' ' ' LYS . 75.5 m-85 -73.64 109.85 7.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.752 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.556 HD11 ' HB3' ' A' ' 86' ' ' ARG . 11.2 mp -85.3 34.6 0.57 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.811 0.815 . . . . 0.0 108.983 168.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 56' ' ' PHE . 9.9 t0 -116.59 111.02 19.3 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.387 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -55.08 -56.14 23.2 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -171.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 60' ' ' LYS . 4.3 mptp? -72.4 -26.39 61.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.603 0.239 . . . . 0.0 111.489 -176.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.558 ' O ' HG12 ' A' ' 65' ' ' ILE . 0.4 OUTLIER -74.5 -37.93 62.99 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 178.044 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.437 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.0 ttm180 -61.76 -40.78 96.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.182 0.515 . . . . 0.0 109.958 175.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.39 -39.7 94.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.723 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -64.2 -37.87 89.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.547 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.558 HG12 ' O ' ' A' ' 61' ' ' TYR . 44.5 mm -65.42 -35.2 74.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.863 0.363 . . . . 0.0 111.042 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.04 -22.45 52.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.268 0.556 . . . . 0.0 109.562 176.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -79.11 -18.8 52.61 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.417 -176.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.9 m -93.76 131.12 41.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.345 0.593 . . . . 0.0 110.726 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.2 p -88.0 -18.88 28.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.287 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.436 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 42.0 t -80.89 124.49 81.48 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.928 -177.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 18.5 Cg_exo -68.15 -39.81 9.83 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.236 2.624 . . . . 0.0 111.992 177.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.9 tpt -65.57 -35.35 80.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.757 -176.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.655 ' O ' ' HG2' ' A' ' 77' ' ' MET . 92.8 t -66.98 -44.15 88.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.392 178.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.39 -40.03 85.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.947 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.77 -37.79 85.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.8 0.334 . . . . 0.0 110.429 175.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -64.13 -37.9 89.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.302 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.655 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 6.7 mmt -60.31 -57.13 14.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.5 0.667 . . . . 0.0 109.973 176.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.574 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -80.5 3.08 75.35 Favored Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.121 -0.945 . . . . 0.0 113.346 -174.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -80.2 -19.54 46.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 117.088 0.444 . . . . 0.0 110.1 175.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -79.08 172.56 13.64 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.894 0.378 . . . . 0.0 110.001 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -134.14 1.69 3.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.949 0.404 . . . . 0.0 110.321 -176.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.6 p -88.24 -5.16 58.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.96 0.41 . . . . 0.0 111.58 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.807 ' HE3' ' HD2' ' A' ' 84' ' ' PRO . 30.4 mmmt -89.96 151.54 45.34 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.751 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.807 ' HD2' ' HE3' ' A' ' 83' ' ' LYS . 18.9 Cg_endo -57.19 119.01 5.99 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.286 2.658 . . . . 0.0 113.182 -177.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.606 HD21 ' HE3' ' A' ' 55' ' ' LYS . 57.8 mt -107.18 169.02 8.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.186 178.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.568 ' HG2' ' HB2' ' A' ' 89' ' ' TRP . 12.7 ptm180 -100.28 175.95 5.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.822 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -60.11 -69.31 0.22 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.253 -171.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -97.38 36.38 1.48 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.792 0.33 . . . . 0.0 111.108 -176.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.599 ' CZ2' ' HB2' ' A' ' 55' ' ' LYS . 33.3 t-105 -58.66 -35.13 72.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.859 0.361 . . . . 0.0 111.75 -178.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.428 ' CD ' ' HZ3' ' A' ' 93' ' ' LYS . 63.7 mm-40 -73.5 -16.99 61.27 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.295 -177.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.9 m -99.69 -37.54 9.07 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.877 0.37 . . . . 0.0 111.282 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.404 ' O ' HG23 ' A' ' 96' ' ' VAL . 34.0 m -85.81 3.01 4.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -172.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.526 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 59.0 mttp -55.11 -46.49 75.57 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.061 0.458 . . . . 0.0 111.5 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.456 ' HG2' ' H ' ' A' ' 94' ' ' GLU . 3.9 pt-20 -68.06 -25.43 65.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.348 -177.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -75.03 -43.81 51.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.906 0.384 . . . . 0.0 110.117 176.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 92' ' ' VAL . 88.9 t -61.16 -47.33 94.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.643 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.8 mtt -65.94 -32.94 74.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.492 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.687 HH21 HD23 ' A' ' 148' ' ' LEU . 27.7 ttm180 -60.87 -43.87 97.82 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.842 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -69.51 -40.49 76.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.76 0.314 . . . . 0.0 110.543 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.1 -47.64 76.48 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.45 HD13 HD21 ' A' ' 149' ' ' LEU . 69.9 mt -66.8 -37.04 83.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.291 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.511 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 52.1 ttt180 -60.21 -48.78 80.3 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.826 177.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.567 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -58.52 -30.43 67.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.889 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.561 ' HA ' HG22 ' A' ' 37' ' ' ILE . 55.9 tttt -66.05 -55.0 18.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.16 177.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -74.9 -10.87 59.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.099 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.539 ' HA ' HH21 ' A' ' 112' ' ' ARG . 60.3 mt-10 -88.3 -27.79 21.48 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.885 0.374 . . . . 0.0 110.395 172.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.567 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 1.3 tp-100 -86.42 -30.82 21.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.732 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -115.24 111.75 21.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.664 0.269 . . . . 0.0 110.818 -177.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.02 -39.35 91.99 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.974 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -53.38 -47.53 69.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.081 0.467 . . . . 0.0 110.93 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.441 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 22.3 mt -74.95 -31.16 61.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.439 -176.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.539 HH21 ' HA ' ' A' ' 106' ' ' GLU . 6.7 tpp180 -56.92 -50.45 72.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.529 176.003 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.99 -38.62 76.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.895 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 60.2 tp -60.3 -45.17 94.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 35.0 tp -62.08 -44.48 96.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.086 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.531 HD21 ' HB2' ' A' ' 156' ' ' LEU . 38.6 mt -74.72 -18.17 60.54 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.66 0.267 . . . . 0.0 111.21 -177.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.95 -23.22 52.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.446 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 57.9 p -71.88 -24.64 61.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.883 0.373 . . . . 0.0 110.931 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.474 ' HB2' ' HE ' ' A' ' 153' ' ' ARG . . . -47.84 136.47 10.62 Favored Pre-proline 0 C--O 1.234 0.25 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.891 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.432 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 27.6 Cg_endo -100.78 33.3 8.6 Favored 'Cis proline' 0 CA--C 1.534 0.511 0 C-N-CA 124.26 -1.142 . . . . 0.0 113.641 -1.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.484 ' HB2' HG11 ' A' ' 11' ' ' VAL . . . -67.53 159.06 30.5 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -175.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.434 ' HB3' HG12 ' A' ' 16' ' ' ILE . 44.3 tttp -88.27 121.33 30.54 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.759 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.0 mt -90.09 114.34 26.24 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.787 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.611 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 61.6 t -129.61 114.96 32.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.625 -0.262 . . . . 0.0 111.118 -178.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -74.18 118.53 17.24 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.513 ' HA ' ' HB2' ' A' ' 135' ' ' ASP . 80.8 t60 -85.53 77.51 9.85 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.865 -0.734 . . . . 0.0 109.188 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.51 107.31 9.87 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.633 178.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -106.61 15.93 25.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.553 0.692 . . . . 0.0 110.404 -175.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -125.98 -25.04 3.65 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.371 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -131.86 136.78 47.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.49 176.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.53 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -99.9 85.81 3.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.34 0.591 . . . . 0.0 109.843 173.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 5.6 t80 178.07 140.32 0.09 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.006 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.752 ' HB3' HD22 ' A' ' 145' ' ' LEU . 12.2 m95 74.93 6.29 4.33 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.872 0.732 . . . . 0.0 112.089 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -172.3 -113.85 0.31 Allowed Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 118.572 -1.775 . . . . 0.0 114.369 -178.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.513 ' HB2' ' HA ' ' A' ' 126' ' ' HIS . 9.8 t70 -98.57 -49.42 4.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.068 -0.566 . . . . 0.0 112.007 -167.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . 0.53 ' HA2' ' HA ' ' A' ' 131' ' ' ALA . . . 82.6 -6.22 70.41 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.981 -177.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 94.2 16.95 41.86 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.586 -0.606 . . . . 0.0 111.586 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 20.4 p80 -168.6 24.91 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.501 -0.35 . . . . 0.0 111.005 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 79.08 -46.29 2.93 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.389 -0.434 . . . . 0.0 113.891 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -88.25 68.18 8.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.126 0.965 . . . . 0.0 110.67 -173.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -122.87 15.42 8.38 Favored Glycine 0 C--N 1.311 -0.82 0 CA-C-N 114.002 -1.454 . . . . 0.0 111.86 177.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 45.9 mttt 72.55 80.87 0.14 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.492 0.663 . . . . 0.0 111.36 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.406 HD21 ' HA ' ' A' ' 124' ' ' VAL . 4.9 t-20 -67.49 4.79 0.93 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.741 -1.118 . . . . 0.0 111.774 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.724 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 12.3 ttp180 -58.22 -22.1 50.61 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.866 -0.521 . . . . 0.0 112.239 -175.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.752 HD22 ' HB3' ' A' ' 133' ' ' TRP . 41.8 tp -66.08 -48.47 70.86 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 174.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -64.46 -28.9 73.77 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 174.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -68.83 -37.31 79.08 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 79.7 mt -58.85 -47.61 84.27 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 172.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.45 HD21 HD13 ' A' ' 101' ' ' LEU . 96.0 mt -61.77 -38.5 88.23 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.866 178.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.408 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 72.4 mtm -72.11 -40.16 68.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.656 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -67.19 -38.66 85.75 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.121 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.541 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 61.3 tp -62.32 -46.21 89.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.687 174.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.474 ' HE ' ' HB2' ' A' ' 119' ' ' ALA . 2.8 ttp-105 -52.23 -44.99 65.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.644 175.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -67.44 -38.83 85.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.6 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -72.61 -35.62 67.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.903 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 76.5 mt -74.78 -23.54 58.53 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 176.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.404 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -72.4 -25.16 61.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.441 175.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.73 -39.75 82.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 175.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -63.34 -38.54 91.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.341 174.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -63.88 -41.1 97.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.23 176.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . 0.404 HD13 ' O ' ' A' ' 157' ' ' ALA . 8.3 mp -67.4 -46.26 73.78 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.423 178.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 . . . . . 0 C--N 1.327 -0.376 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -176.311 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 37.6 t . . . . . 0 N--CA 1.453 -0.287 0 CA-C-O 121.297 0.57 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -107.42 29.8 6.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.314 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.85 76.75 1.15 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.142 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.577 178.795 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.4 m -70.99 151.38 9.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.966 0.413 . . . . 0.0 110.556 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.481 ' HG2' ' OG1' ' A' ' 15' ' ' THR . 0.0 OUTLIER -75.35 -66.66 0.74 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.234 -178.617 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' MET . 58.3 tt0 174.51 -39.11 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.164 -0.925 . . . . 0.0 109.047 176.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -82.78 12.28 4.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.431 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.501 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 18.0 m -82.44 138.75 34.31 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.576 -174.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.635 HG12 ' HE3' ' A' ' 122' ' ' LYS . 61.2 mt -124.81 120.81 59.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.201 174.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.2 mp -89.98 101.22 12.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.628 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 18.7 m120 -91.77 101.06 13.66 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 176.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.428 ' HB2' ' CB ' ' A' ' 26' ' ' TYR . 37.1 p90 -107.38 174.82 5.72 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.344 -174.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.57 -179.26 5.58 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.266 -177.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.481 ' HA ' ' OG ' ' A' ' 30' ' ' SER . 17.2 m -64.51 -173.51 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.84 0.713 . . . . 0.0 112.356 -176.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.718 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 34.2 p -67.34 2.69 1.55 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -169.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.4 t -92.93 12.06 25.15 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.372 0.606 . . . . 0.0 109.801 176.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -129.22 166.63 19.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.172 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -61.55 -35.29 77.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.893 0.378 . . . . 0.0 110.668 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.428 ' CB ' ' HB2' ' A' ' 19' ' ' PHE . 98.8 m-85 -80.76 -1.42 42.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.954 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.718 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -57.03 -23.0 44.69 Favored Glycine 0 CA--C 1.52 0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 114.408 -174.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -69.44 -14.19 62.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 117.524 0.662 . . . . 0.0 111.27 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -73.44 -38.92 65.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.801 -0.181 . . . . 0.0 110.851 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.481 ' OG ' ' HA ' ' A' ' 21' ' ' SER . 64.6 m -59.27 158.84 8.51 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.674 0.749 . . . . 0.0 112.964 -173.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -69.96 -19.82 63.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.549 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.624 ' CE1' ' HB2' ' A' ' 71' ' ' PRO . 13.0 t80 -92.54 7.24 44.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.542 -176.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.417 ' HB1' ' HD1' ' A' ' 35' ' ' TRP . . . -72.52 129.0 37.3 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.593 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.521 ' HA ' HG23 ' A' ' 46' ' ' THR . . . -80.17 60.39 3.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.255 0.55 . . . . 0.0 111.387 -175.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.417 ' HD1' ' HB1' ' A' ' 33' ' ' ALA . 58.5 m95 -111.16 112.43 55.15 Favored Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.388 174.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.446 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 42.2 Cg_exo -57.13 126.91 23.65 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 123.183 2.589 . . . . 0.0 113.237 -175.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.504 ' CG1' ' HB2' ' A' ' 44' ' ' TRP . 37.6 pt -103.33 145.2 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.49 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.514 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 14.9 tptm -108.39 92.59 4.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.957 0.408 . . . . 0.0 109.901 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 26.1 t -121.33 128.25 75.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.136 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.7 t70 66.8 16.91 10.49 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.811 0.815 . . . . 0.0 110.255 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.9 10.97 83.34 Favored Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.703 -176.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 57.6 mttp -111.01 143.26 41.98 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 56.8 m -94.48 113.28 25.1 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.534 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.504 ' HB2' ' CG1' ' A' ' 37' ' ' ILE . 62.4 m95 -104.31 126.0 32.72 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 176.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 23.3 Cg_exo -62.91 -13.63 36.01 Favored 'Trans proline' 0 N--CA 1.473 0.281 0 C-N-CA 123.177 2.585 . . . . 0.0 113.059 -175.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.521 HG23 ' HA ' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -164.91 151.8 10.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.069 -178.256 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.9 m -58.53 -34.1 70.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.102 0.477 . . . . 0.0 109.954 175.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 51' ' ' PHE . 15.9 tm-20 -54.1 -42.97 69.98 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.311 177.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -69.54 -37.19 76.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.6 -175.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.468 ' CE2' HG13 ' A' ' 96' ' ' VAL . 90.8 t80 -69.91 -35.95 75.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 176.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.476 ' CZ ' ' HZ2' ' A' ' 89' ' ' TRP . 68.6 t80 -56.29 -52.51 64.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.761 177.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.638 ' NE2' ' HA ' ' A' ' 75' ' ' ALA . 17.1 mm-40 -66.81 -50.11 63.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.134 -178.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.51 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -58.51 -30.47 67.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.353 -177.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.505 HE21 ' HA ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -78.4 -42.92 28.82 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.154 178.216 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.549 ' HG2' HD22 ' A' ' 85' ' ' LEU . 27.3 ttpp -57.06 -39.65 75.32 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.158 -177.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -92.46 139.77 30.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.401 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.825 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.5 pt? -113.45 18.4 17.73 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.371 0.605 . . . . 0.0 110.275 -178.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -96.11 128.25 42.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.631 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -60.75 -48.01 83.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.463 -177.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -59.12 -46.38 88.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.701 0.286 . . . . 0.0 111.498 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.522 ' CZ ' ' HE3' ' A' ' 83' ' ' LYS . 2.5 t80 -74.39 -32.59 62.78 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.01 -174.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.51 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 41.7 ttm180 -64.88 -35.32 80.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.226 0.536 . . . . 0.0 109.618 174.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.537 ' HG2' ' HD3' ' A' ' 67' ' ' ARG . 31.1 tt0 -70.24 -31.39 68.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.247 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -59.8 -48.85 80.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.042 0.449 . . . . 0.0 110.154 173.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.436 HG21 ' HB2' ' A' ' 52' ' ' GLN . 37.8 mm -62.14 -37.98 79.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.005 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -71.38 -23.81 61.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.019 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.537 ' HD3' ' HG2' ' A' ' 63' ' ' GLU . 25.5 mtp180 -99.78 13.68 32.87 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -173.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.7 m -118.69 132.41 68.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.073 0.463 . . . . 0.0 110.35 174.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.9 m -84.91 -30.72 24.14 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.084 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.431 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 39.6 m -81.19 122.2 81.2 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.036 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.624 ' HB2' ' CE1' ' A' ' 32' ' ' PHE . 10.8 Cg_exo -70.97 -33.31 12.2 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 123.073 2.515 . . . . 0.0 111.795 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.451 ' O ' ' HG3' ' A' ' 76' ' ' ARG . 52.3 ttm -60.82 -39.51 89.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.803 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.516 ' O ' ' HG3' ' A' ' 77' ' ' MET . 84.1 t -61.15 -52.0 66.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.327 177.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.7 98.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.025 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.638 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -60.32 -50.33 74.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.596 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 72' ' ' MET . 77.1 mtp180 -64.77 -47.78 76.93 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -175.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.516 ' HG3' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -85.01 -8.29 58.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.979 0.419 . . . . 0.0 111.391 -177.696 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -93.87 -17.09 42.36 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.916 176.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -89.87 -1.15 57.92 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -175.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -82.37 131.23 35.23 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.018 174.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -106.13 22.68 15.29 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.626 0.727 . . . . 0.0 110.459 -170.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 59.8 m -70.87 -36.8 72.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.729 173.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.522 ' HE3' ' CZ ' ' A' ' 61' ' ' TYR . 16.1 pttm -86.53 158.12 54.74 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.797 175.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.438 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 60.7 Cg_endo -71.71 154.71 59.28 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.616 2.211 . . . . 0.0 113.473 -174.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.549 HD22 ' HG2' ' A' ' 55' ' ' LYS . 52.9 mt -121.57 171.95 8.45 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 175.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -70.79 141.18 51.4 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.7 -0.8 . . . . 0.0 109.37 174.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.471 ' HE3' ' HB2' ' A' ' 87' ' ' LYS . 35.1 ttmt -61.24 -46.66 89.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.168 -169.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -86.75 24.29 1.5 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.485 ' HA ' HG22 ' A' ' 92' ' ' VAL . 65.7 t-105 -59.06 -36.03 74.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.737 0.304 . . . . 0.0 111.56 -177.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.89 -30.46 67.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.839 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 28.8 m -94.8 -40.58 9.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.849 0.356 . . . . 0.0 111.075 -177.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.5 m -79.06 -8.08 11.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -176.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 97' ' ' MET . 62.3 tttp -52.83 -46.5 67.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.653 0.264 . . . . 0.0 111.155 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -77.63 -28.83 51.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.696 0.284 . . . . 0.0 111.061 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -68.88 -42.25 77.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.088 0.471 . . . . 0.0 109.988 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.468 HG13 ' CE2' ' A' ' 50' ' ' TYR . 75.4 t -61.35 -46.76 95.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.396 176.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.456 ' HG2' ' O ' ' A' ' 93' ' ' LYS . 83.2 mmm -61.04 -40.07 92.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.809 178.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 25.7 ttm-85 -62.26 -43.64 98.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.544 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -61.9 -44.46 96.75 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.884 0.373 . . . . 0.0 110.589 178.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.92 -44.21 93.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.121 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -69.53 -41.22 76.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.014 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -58.34 -53.67 55.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.539 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.97 -26.56 68.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.949 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -65.06 -55.31 19.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.64 178.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -79.3 -6.39 56.61 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.947 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.778 ' HA ' HH21 ' A' ' 112' ' ' ARG . 20.9 mt-10 -92.08 -35.45 13.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.598 0.237 . . . . 0.0 110.999 173.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.514 ' NE2' ' HB2' ' A' ' 38' ' ' LYS . 0.8 OUTLIER -66.41 -45.1 81.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.027 0.442 . . . . 0.0 110.364 179.23 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -113.81 111.41 21.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.114 -176.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.36 -22.14 66.25 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.61 178.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -57.12 -49.02 77.21 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.362 0.601 . . . . 0.0 109.873 175.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.8 mt -69.32 -38.39 78.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.231 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.778 HH21 ' HA ' ' A' ' 106' ' ' GLU . 42.5 ttm180 -58.42 -43.7 88.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.508 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.94 -43.03 99.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.836 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.7 tp -65.97 -40.15 91.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.537 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.665 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 44.0 tp -65.62 -35.39 80.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.985 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.1 mp -88.55 -3.77 58.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.881 0.372 . . . . 0.0 111.077 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.12 -34.73 24.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.048 0.452 . . . . 0.0 109.792 172.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 20.9 p -75.23 -14.96 60.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.936 176.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.414 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -59.3 138.23 88.65 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.275 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 67.7 Cg_endo -104.99 39.66 3.47 Favored 'Cis proline' 0 N--CA 1.458 -0.6 0 C-N-CA 124.819 -0.909 . . . . 0.0 113.2 -2.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.501 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -75.48 176.28 7.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.94 0.4 . . . . 0.0 111.821 -176.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.635 ' HE3' HG12 ' A' ' 16' ' ' ILE . 51.6 mtmt -92.92 130.78 38.39 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.187 -179.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 59.8 mt -94.07 113.62 25.62 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.993 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.628 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 86.1 t -132.82 107.07 11.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.494 -175.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -77.34 117.82 19.2 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.439 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 7.4 t60 -85.71 113.32 21.81 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 3.6 t -136.95 112.49 9.34 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.382 0.611 . . . . 0.0 109.896 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.0 18.73 17.74 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.043 0.925 . . . . 0.0 108.548 171.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -95.53 -44.46 7.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.125 177.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -130.02 166.74 19.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.148 176.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.64 86.34 2.23 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.405 175.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -160.11 -35.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.124 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.671 ' HB3' HD22 ' A' ' 145' ' ' LEU . 71.5 m95 -120.79 20.71 11.63 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.485 -179.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -150.73 -150.31 5.26 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.43 -175.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.439 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 1.3 p-10 -82.43 -14.93 54.32 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 122.291 -0.534 . . . . 0.0 110.334 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . 0.569 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 68.0 26.42 73.99 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.886 176.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 76.81 -27.26 1.64 Allowed Glycine 0 CA--C 1.52 0.375 0 N-CA-C 114.31 0.484 . . . . 0.0 114.31 176.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . 0.468 ' NE2' ' HB3' ' A' ' 140' ' ' LYS . 20.7 p-80 -132.65 11.78 4.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.518 0.659 . . . . 0.0 111.801 -172.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 99.32 -27.09 21.72 Favored Glycine 0 CA--C 1.517 0.166 0 C-N-CA 120.552 -0.832 . . . . 0.0 113.048 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.468 ' HB3' ' NE2' ' A' ' 138' ' ' HIS . 65.6 tttp -107.4 69.97 0.77 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.587 0.708 . . . . 0.0 110.025 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.569 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -124.19 15.23 7.78 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.257 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 61.2 mttt 61.97 77.05 0.34 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.773 0.797 . . . . 0.0 110.929 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.424 ' OD1' HG13 ' A' ' 124' ' ' VAL . 8.8 t30 -77.9 5.58 9.39 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.75 -176.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.493 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 69.0 mtp85 -47.37 -22.22 0.4 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -178.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.671 HD22 ' HB3' ' A' ' 133' ' ' TRP . 49.2 tp -56.59 -47.54 79.37 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.272 0.558 . . . . 0.0 110.237 173.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.613 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -67.42 -27.96 73.59 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.792 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -68.93 -37.87 79.17 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 79.6 mt -61.26 -41.87 97.67 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.6 -34.33 78.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.837 177.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.613 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 67.4 mtt -61.48 -49.24 77.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.73 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -67.38 -37.15 82.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.71 0.29 . . . . 0.0 110.805 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 68.1 tp -63.67 -42.77 98.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.032 0.444 . . . . 0.0 110.065 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.665 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 1.1 ttp-105 -61.7 -42.55 99.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.954 177.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -57.52 -43.97 84.72 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.219 177.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -66.65 -45.5 78.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.255 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.503 HD12 HD23 ' A' ' 115' ' ' LEU . 90.9 mt -69.41 -28.16 65.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.828 0.347 . . . . 0.0 110.627 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -60.8 -45.46 94.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.186 175.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 69.8 mt -69.14 -34.07 61.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.72 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -56.39 -52.8 63.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.045 0.45 . . . . 0.0 109.79 177.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -76.44 -25.2 54.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.769 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 13.7 tp -70.11 -32.56 70.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.195 0.521 . . . . 0.0 110.005 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.444 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.189 177.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 C--O 1.236 0.342 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -82.68 84.79 7.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.667 0.746 . . . . 0.0 109.941 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.95 44.75 1.15 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.682 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 . . . . . 0 C--N 1.328 -0.349 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 173.857 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.8 m80 . . . . . 0 N--CA 1.465 0.301 0 CA-C-O 121.117 0.484 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.421 HG21 ' HB2' ' A' ' 121' ' ' ALA . 32.3 m -83.73 179.91 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.909 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 29.0 mtm -91.92 164.33 13.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.02 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -58.08 116.75 3.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.338 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 52.01 74.16 0.28 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.523 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.43 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 31.5 m -96.8 121.72 38.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.858 177.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 35.3 mm -81.33 95.78 2.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 176.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.9 mt -90.07 91.61 3.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.443 0.639 . . . . 0.0 109.794 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.62 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.3 p30 -96.49 101.96 13.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.421 178.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -102.81 132.08 49.24 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.519 -172.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -150.2 100.47 2.9 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.566 173.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.515 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 18.4 t 176.29 61.7 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -177.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.2 m -74.53 2.72 9.01 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.32 -171.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.36 -79.0 0.02 OUTLIER 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -175.37 81.65 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -170.55 -110.43 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.883 -172.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -101.26 -15.69 17.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.2 0.524 . . . . 0.0 110.243 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.515 ' HA3' ' O ' ' A' ' 21' ' ' SER . . . -74.08 -0.45 56.45 Favored Glycine 0 CA--C 1.52 0.364 0 CA-C-N 115.863 -0.608 . . . . 0.0 113.303 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.36 -1.56 3.57 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.023 0.44 . . . . 0.0 112.004 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.409 ' O ' ' HE2' ' A' ' 104' ' ' LYS . 15.3 m-85 -65.17 -32.31 73.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.578 169.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.9 m -62.99 156.71 23.82 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.437 0.637 . . . . 0.0 112.046 -174.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.624 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 5.5 p-10 -70.66 -24.93 62.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.906 178.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -76.6 -2.26 31.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.715 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.442 ' O ' HG22 ' A' ' 46' ' ' THR . . . -64.72 136.1 56.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.945 -177.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.79 57.83 2.66 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.456 -172.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 66.2 m95 -116.63 105.5 49.88 Favored Pre-proline 0 C--N 1.316 -0.86 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.607 177.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.27 138.18 78.86 Favored 'Trans proline' 0 C--O 1.238 0.482 0 C-N-CA 123.324 2.683 . . . . 0.0 113.029 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.403 HG13 ' HB2' ' A' ' 44' ' ' TRP . 16.2 pt -123.81 137.65 56.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.363 -178.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.413 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 46.1 tptt -98.66 107.67 20.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.423 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.0 t -123.72 113.27 36.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -174.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 55.27 36.72 27.65 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.437 172.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.08 -1.18 62.74 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.502 173.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HE3' ' CZ2' ' A' ' 44' ' ' TRP . 54.4 mtmt -129.34 144.7 51.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 117.635 0.718 . . . . 0.0 110.42 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.0 m -98.53 122.74 42.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.861 -175.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.478 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 41.5 m95 -112.16 134.55 21.44 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.642 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 37.9 Cg_exo -60.79 -41.63 44.56 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.833 2.355 . . . . 0.0 112.554 -177.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.442 HG22 ' O ' ' A' ' 33' ' ' ALA . 21.0 p -144.77 178.63 7.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.698 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.624 ' HB2' ' HB2' ' A' ' 31' ' ' ASN . 21.5 m -74.02 -44.1 55.62 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -173.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.494 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 1.9 pm0 -76.93 -10.31 59.28 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.502 -173.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.538 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 11.2 m80 -71.74 -38.01 70.49 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 172.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -71.46 -35.81 70.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.494 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 83.0 t80 -59.89 -56.42 21.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.549 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.521 ' NE2' ' HA3' ' A' ' 78' ' ' GLY . 5.1 mm100 -66.28 -21.7 66.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.211 -0.45 . . . . 0.0 112.016 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.457 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -76.32 -48.99 18.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.004 0.43 . . . . 0.0 110.455 176.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.47 -14.48 62.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.136 0.493 . . . . 0.0 110.338 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -60.64 -34.45 74.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.769 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.514 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 96.8 m-85 -109.17 157.7 18.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.383 -178.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.461 HD12 ' H ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -112.14 32.7 5.33 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.265 0.555 . . . . 0.0 111.1 -177.883 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.504 ' OD2' ' HB2' ' A' ' 60' ' ' LYS . 8.6 t70 -136.0 118.34 15.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.518 178.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.58 ' HA ' ' HB2' ' A' ' 62' ' ' ARG . 21.4 mm-40 -65.97 -14.07 60.93 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -177.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.504 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . 58.4 mttp -72.71 -55.11 7.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.96 0.409 . . . . 0.0 109.956 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.42 ' O ' HG12 ' A' ' 65' ' ' ILE . 55.2 t80 -71.6 -26.0 62.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.933 0.397 . . . . 0.0 110.321 177.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.58 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . 12.5 mtp180 -71.44 -27.34 63.21 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.805 0.336 . . . . 0.0 110.507 175.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.3 tt0 -69.91 -32.38 70.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 170.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.02 -40.75 95.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.591 175.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.42 HG12 ' O ' ' A' ' 61' ' ' TYR . 40.5 mm -65.16 -29.79 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.693 0.758 . . . . 0.0 110.29 175.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -74.58 -29.54 61.37 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.267 174.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -81.01 -28.47 35.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.207 -177.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.458 ' O ' HG13 ' A' ' 68' ' ' VAL . 10.3 p -70.83 101.37 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.722 0.772 . . . . 0.0 110.139 177.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.9 m -76.05 -26.17 56.32 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.966 -177.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.479 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.1 m -78.97 133.47 61.46 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.395 178.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.538 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 28.0 Cg_exo -62.12 -65.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.359 2.706 . . . . 0.0 113.986 -175.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 27.8 ttt -68.95 -26.45 65.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.776 0.322 . . . . 0.0 111.5 -172.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 86.3 t -62.82 -28.88 45.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.041 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.77 -47.49 84.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.031 0.443 . . . . 0.0 110.707 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.99 -30.52 62.52 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.95 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.42 ' HE ' ' C ' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -63.11 -49.12 75.65 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.574 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -77.54 -24.67 49.87 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 176.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.521 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -76.78 -2.14 75.17 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.274 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 76' ' ' ARG . 21.3 mmt180 -67.18 -18.77 65.41 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 122.31 0.244 . . . . 0.0 110.883 170.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.523 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 20.5 t70 -69.07 134.12 48.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.024 0.44 . . . . 0.0 110.402 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 81' ' ' ARG . 24.6 ttp-105 -118.18 17.87 13.89 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.278 -175.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 88.2 p -98.13 0.39 45.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.503 0.668 . . . . 0.0 109.593 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.523 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 41.1 mmtm -95.75 153.26 39.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 174.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.69 103.85 1.71 Allowed 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 121.44 1.426 . . . . 0.0 112.075 -178.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.416 HD21 ' HG3' ' A' ' 81' ' ' ARG . 2.4 pp -109.68 169.85 8.44 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.165 176.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 -86.07 133.23 33.9 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.04 -176.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -70.6 -33.39 71.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.842 0.353 . . . . 0.0 111.0 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -85.4 9.98 14.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.096 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.468 ' HA ' HG22 ' A' ' 92' ' ' VAL . 67.8 t-105 -54.5 -30.44 53.43 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.969 0.414 . . . . 0.0 110.203 175.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -53.66 -32.23 50.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.618 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.2 m -99.82 -45.46 5.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.698 0.285 . . . . 0.0 111.498 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.468 HG22 ' HA ' ' A' ' 89' ' ' TRP . 31.9 m -74.94 -11.22 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -171.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.4 pttm -63.27 -29.59 70.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.771 0.32 . . . . 0.0 110.647 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.495 ' OE1' ' HD3' ' A' ' 144' ' ' ARG . 9.5 mm-40 -68.16 -39.89 82.47 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.644 0.735 . . . . 0.0 109.49 177.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.87 -41.66 67.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.882 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.416 HG21 ' CZ3' ' A' ' 89' ' ' TRP . 79.7 t -63.8 -39.55 85.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.065 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.8 mmt -62.49 -46.14 89.81 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.576 176.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.719 HH21 HD23 ' A' ' 148' ' ' LEU . 26.1 ttm180 -63.75 -32.57 74.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.35 . . . . 0.0 110.545 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -63.93 -50.33 69.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.365 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.36 87.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.976 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.6 -35.52 80.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.098 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -58.88 -53.83 53.97 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.95 -37.51 82.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.739 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.409 ' HE2' ' O ' ' A' ' 29' ' ' PHE . 59.0 tttp -52.61 -54.02 38.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.357 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -86.5 -8.38 57.62 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.714 ' HA ' HH21 ' A' ' 112' ' ' ARG . 24.9 mt-10 -92.61 -33.01 14.58 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 121.868 -0.52 . . . . 0.0 111.518 175.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.413 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 78.5 mm-40 -79.17 -30.87 43.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.674 0.273 . . . . 0.0 110.761 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -115.28 103.38 10.76 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.778 0.323 . . . . 0.0 110.997 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.474 ' HA ' ' HB3' ' A' ' 112' ' ' ARG . . . -65.26 -24.42 67.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.513 178.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.517 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 2.0 mp0 -51.4 -56.08 15.13 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.455 172.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.9 mt -74.2 -31.65 62.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.333 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.714 HH21 ' HA ' ' A' ' 106' ' ' GLU . 13.7 tpp85 -50.48 -60.62 2.82 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.316 177.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.16 -34.35 70.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.025 -176.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.91 -40.22 94.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.434 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 29.3 tp -67.64 -49.56 62.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.278 178.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.541 HD21 ' HB2' ' A' ' 156' ' ' LEU . 53.0 mt -63.56 -24.89 68.0 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -173.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -74.47 -7.22 52.28 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 72.0 p -86.8 -15.4 39.38 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.363 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.432 ' HA ' HH21 ' A' ' 153' ' ' ARG . . . -54.87 141.86 56.74 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.394 177.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.583 ' HA ' HH21 ' A' ' 153' ' ' ARG . 43.9 Cg_endo -101.22 41.94 3.45 Favored 'Cis proline' 0 CA--C 1.535 0.572 0 C-N-CA 124.5 -1.042 . . . . 0.0 113.134 -1.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.43 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -72.92 166.93 22.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.94 0.4 . . . . 0.0 111.704 -178.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 39.3 tttp -100.98 119.35 38.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.589 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 24.2 mt -88.7 125.35 34.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.433 -175.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.62 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 42.2 t -134.36 134.11 54.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.432 -175.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.517 ' HB3' ' HA3' ' A' ' 134' ' ' GLY . 0.0 OUTLIER -81.02 137.66 36.04 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.31 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 18' ' ' ASN . 23.7 t-160 -130.77 79.94 1.92 Allowed 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.55 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.5 t -87.55 166.22 14.9 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 164.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -140.16 67.75 1.37 Allowed 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.833 0.825 . . . . 0.0 110.454 -176.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -162.69 -44.85 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.866 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . 0.507 ' O ' ' HA2' ' A' ' 136' ' ' GLY . 2.6 m-20 -125.9 -179.9 4.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -124.17 86.19 2.53 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 170.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -97.35 -49.55 4.88 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -167.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.629 ' HB3' ' HB2' ' A' ' 145' ' ' LEU . 78.9 m95 -140.06 25.18 2.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.457 0.646 . . . . 0.0 110.588 178.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.517 ' HA3' ' HB3' ' A' ' 125' ' ' GLU . . . -163.07 -84.22 0.05 OUTLIER Glycine 0 N--CA 1.439 -1.163 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.575 -177.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -160.1 164.28 33.17 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.502 -178.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . 0.507 ' HA2' ' O ' ' A' ' 130' ' ' ASP . . . -98.38 24.12 33.32 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 175.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 74.24 37.27 48.76 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 115.071 -0.565 . . . . 0.0 113.748 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -144.58 -27.0 0.5 Allowed 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' A' ' 140' ' ' LYS . . . 99.71 56.44 0.96 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.282 -0.485 . . . . 0.0 113.218 174.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 139' ' ' GLY . 13.0 ttpp 169.86 69.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 123.675 0.79 . . . . 0.0 109.126 176.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -132.35 -65.11 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 119.333 -1.413 . . . . 0.0 114.363 -175.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 39.6 tttm -178.51 52.08 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.499 0.65 . . . . 0.0 111.088 -171.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.509 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 3.4 t-20 -69.28 5.29 1.32 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.076 0.95 . . . . 0.0 111.708 -177.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.702 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 1.6 ttt180 -57.58 -21.43 38.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.629 ' HB2' ' HB3' ' A' ' 133' ' ' TRP . 23.6 tp -65.53 -44.45 86.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.357 175.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -66.35 -32.14 81.06 Favored Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.177 175.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -61.85 -40.57 95.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.017 0.437 . . . . 0.0 110.032 175.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.719 HD23 HH21 ' A' ' 98' ' ' ARG . 46.4 mt -63.73 -45.5 89.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.767 174.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.4 mt -61.02 -46.24 91.53 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.33 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 58.1 mtm -64.84 -43.4 93.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.907 -176.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 155' ' ' GLN . 33.4 mt-10 -63.73 -44.97 91.96 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.64 176.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 58.7 tp -58.82 -45.21 90.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.182 0.515 . . . . 0.0 110.161 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.849 HH11 ' HB3' ' A' ' 153' ' ' ARG . 1.2 ttp-105 -57.82 -43.48 85.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.873 177.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.7 -40.79 97.66 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.802 177.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.896 HE21 ' HA ' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -65.87 -41.45 91.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.749 179.437 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.541 ' HB2' HD21 ' A' ' 116' ' ' LEU . 97.2 mt -66.13 -36.36 82.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.859 0.361 . . . . 0.0 110.267 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -63.72 -42.48 97.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.858 177.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 77.5 mt -70.22 -43.79 78.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.704 0.288 . . . . 0.0 111.046 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -62.71 -29.12 70.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.293 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -87.28 -29.66 21.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.433 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 15.9 tp -62.05 -35.49 78.79 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.879 -177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 115.782 -0.644 . . . . 0.0 112.175 -176.307 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.479 ' O ' ' HB2' ' A' ' 25' ' ' ASP . 12.5 p . . . . . 0 C--O 1.225 -0.187 0 CA-C-O 120.378 0.133 . . . . 0.0 111.355 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 4' ' ' ARG . 14.7 mtp180 66.27 -79.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.303 -175.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.557 ' HB1' HD22 ' A' ' 114' ' ' LEU . . . 73.01 -40.29 0.47 Allowed 'General case' 0 N--CA 1.469 0.497 0 O-C-N 124.004 0.815 . . . . 0.0 112.062 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 . . . . . 0 C--N 1.325 -0.458 0 CA-C-O 120.905 0.383 . . . . 0.0 111.773 -178.856 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.2 t60 . . . . . 0 N--CA 1.465 0.305 0 CA-C-O 121.271 0.557 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -83.91 168.0 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.269 177.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.497 ' HG2' ' H ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -80.73 -84.55 0.1 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.965 -179.156 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.497 ' H ' ' HG2' ' A' ' 12' ' ' MET . 81.9 mm-40 -133.61 -72.17 0.5 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -175.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -137.16 86.8 2.23 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.712 -171.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.3 t -117.94 149.93 40.08 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.34 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.518 HD13 ' HB2' ' A' ' 122' ' ' LYS . 32.1 mm -94.68 113.18 28.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.924 177.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.0 mt -96.05 101.89 12.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 120.924 0.392 . . . . 0.0 110.301 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.428 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 22.9 m-80 -84.86 104.21 14.61 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.014 177.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -109.92 130.61 55.51 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.92 0.391 . . . . 0.0 110.467 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -150.54 137.82 19.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.968 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.1 m 73.18 130.41 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 O-C-N 124.144 0.902 . . . . 0.0 111.444 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.493 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 20.6 p -56.38 -30.7 63.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.827 -178.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.7 m 62.82 -85.94 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.691 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -160.41 -40.97 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 3' ' ' VAL . 4.3 p-10 -137.54 -52.7 0.65 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 120.154 -0.618 . . . . 0.0 112.595 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -77.68 -9.77 59.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.115 0.483 . . . . 0.0 111.59 -174.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.493 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -76.7 -0.52 68.55 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 116.187 -0.461 . . . . 0.0 113.279 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -53.07 -25.89 14.28 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -62.78 -18.91 63.42 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.9 m -78.84 136.73 37.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.978 0.418 . . . . 0.0 109.943 175.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -65.48 -15.65 62.87 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.837 -174.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.401 ' CE1' ' HB2' ' A' ' 71' ' ' PRO . 2.8 t80 -88.79 20.97 3.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.982 0.42 . . . . 0.0 110.955 -176.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.64 175.42 2.92 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.953 171.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -134.9 81.7 1.91 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.892 0.377 . . . . 0.0 111.681 -176.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.466 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 92.9 m95 -121.1 137.23 26.41 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.465 177.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 7.4 Cg_exo -72.03 112.08 3.33 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.748 2.299 . . . . 0.0 111.544 177.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.509 HG13 ' HB2' ' A' ' 44' ' ' TRP . 17.4 pt -107.27 117.21 52.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.319 0.58 . . . . 0.0 110.649 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -81.58 95.69 7.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.862 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.436 ' HB ' ' CD1' ' A' ' 44' ' ' TRP . 24.7 t -118.61 125.18 74.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.288 -177.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.6 t70 62.48 28.49 16.8 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.714 0.769 . . . . 0.0 110.07 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.32 7.34 87.78 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.375 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -117.67 137.23 52.8 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.648 0.261 . . . . 0.0 110.386 -176.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.1 m -87.72 98.03 11.22 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.434 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.509 ' HB2' HG13 ' A' ' 37' ' ' ILE . 66.9 m95 -90.41 126.19 57.3 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 11.2 Cg_exo -72.15 61.16 3.24 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.852 2.368 . . . . 0.0 112.418 178.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 48' ' ' GLU . 0.5 OUTLIER 93.2 165.15 0.03 OUTLIER 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.338 1.055 . . . . 0.0 111.323 172.821 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.4 p -52.41 -43.91 65.07 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.34 -173.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.405 ' H ' HG23 ' A' ' 46' ' ' THR . 21.7 tp10 -43.56 -45.28 6.56 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 123.553 0.533 . . . . 0.0 112.205 178.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -74.34 -46.17 42.45 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.141 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -60.72 -35.57 76.66 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.152 0.501 . . . . 0.0 110.522 175.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.473 ' CZ ' ' HZ2' ' A' ' 89' ' ' TRP . 81.4 t80 -59.95 -57.45 12.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.239 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -67.3 -34.0 76.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.324 -176.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.95 -30.65 71.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.902 0.382 . . . . 0.0 111.081 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.626 ' HG2' HG22 ' A' ' 96' ' ' VAL . 4.5 tp-100 -85.95 -26.89 25.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.114 0.483 . . . . 0.0 109.893 178.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -67.84 -47.87 67.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.385 -178.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -90.47 143.17 27.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.05 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.66 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.2 pt? -102.66 3.13 36.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.0 110.328 176.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.32 122.87 22.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.639 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -63.58 -51.01 67.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.655 -173.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 63' ' ' GLU . 24.9 ttpp -68.44 -34.21 75.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.817 0.341 . . . . 0.0 110.359 -177.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.658 ' O ' HG12 ' A' ' 65' ' ' ILE . 2.0 t80 -68.34 -34.53 76.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.316 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.412 ' NH2' ' HA ' ' A' ' 57' ' ' LEU . 93.6 mtt180 -62.1 -35.72 79.54 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.989 0.423 . . . . 0.0 110.193 174.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.475 ' HB3' ' O ' ' A' ' 60' ' ' LYS . 10.1 tp10 -61.2 -45.65 93.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.696 174.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -62.04 -35.16 77.76 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.547 176.693 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 61' ' ' TYR . 48.9 mm -62.51 -40.35 87.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.795 0.331 . . . . 0.0 110.766 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -90.03 -0.41 57.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.173 0.511 . . . . 0.0 110.456 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.524 ' HB2' ' HA ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -83.03 -30.31 28.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.328 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.1 m -90.96 133.46 32.62 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.136 -176.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.3 m -81.72 -38.95 24.96 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.641 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.443 ' HB2' HG23 ' A' ' 73' ' ' VAL . 17.0 m -77.9 124.77 86.18 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.266 -177.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.401 ' HB2' ' CE1' ' A' ' 32' ' ' PHE . 35.5 Cg_endo -65.5 -27.86 53.93 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.72 2.28 . . . . 0.0 111.724 177.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 79.6 mtp -60.2 -39.24 85.87 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.887 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.571 ' O ' ' HG2' ' A' ' 77' ' ' MET . 46.0 t -66.53 -43.62 90.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.02 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.23 -47.37 85.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.941 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.543 ' O ' ' HG3' ' A' ' 79' ' ' ARG . . . -61.1 -47.8 84.63 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.891 0.377 . . . . 0.0 111.039 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -58.25 -49.56 76.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.86 -177.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.571 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 26.0 ptt? -81.66 -11.53 59.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.79 0.329 . . . . 0.0 110.94 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -81.26 -16.51 73.97 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.013 -0.613 . . . . 0.0 111.892 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 75' ' ' ALA . 92.9 mtt180 -79.74 -10.32 59.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.554 0.216 . . . . 0.0 110.963 175.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.487 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 22.3 t70 -72.09 140.22 48.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.673 -176.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 87.7 mtm-85 -122.95 20.27 10.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.873 0.368 . . . . 0.0 111.274 -177.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.8 p -98.17 5.69 48.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.556 0.693 . . . . 0.0 109.187 172.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.487 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 43.6 mmtm -102.69 159.28 29.81 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.255 175.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.84 108.08 0.85 Allowed 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.262 1.974 . . . . 0.0 112.498 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 89.0 mt -98.63 151.45 20.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.216 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.623 HH21 ' ND2' ' A' ' 88' ' ' ASN . 16.4 ptm180 -96.88 140.52 31.31 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.353 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.633 ' HE2' ' HA ' ' A' ' 87' ' ' LYS . 0.6 OUTLIER -78.07 -28.3 48.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.146 0.498 . . . . 0.0 109.944 -178.289 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.623 ' ND2' HH21 ' A' ' 86' ' ' ARG . 22.9 p-10 -83.26 15.86 2.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.853 178.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.483 ' HB2' ' HG3' ' A' ' 86' ' ' ARG . 38.0 t-105 -62.41 -37.39 85.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.111 175.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.8 -31.6 72.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.939 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.3 m -71.59 -46.63 58.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.199 -178.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.503 ' O ' HG23 ' A' ' 96' ' ' VAL . 34.8 m -92.37 -1.31 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.549 -175.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.596 ' HG2' ' HZ2' ' A' ' 133' ' ' TRP . 80.8 tttt -48.57 -53.2 19.27 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 123.383 0.673 . . . . 0.0 111.292 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -66.83 -40.58 88.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.855 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -62.15 -49.74 74.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.953 -177.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.626 HG22 ' HG2' ' A' ' 54' ' ' GLN . 77.5 t -58.08 -48.98 82.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.895 -178.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 4.4 mmt -59.6 -53.77 54.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.677 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.43 ' HD3' HD22 ' A' ' 148' ' ' LEU . 38.8 ttp85 -69.94 -29.71 66.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.456 -174.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -70.49 -42.29 71.56 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.62 0.248 . . . . 0.0 110.512 178.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.71 -43.98 87.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.094 0.473 . . . . 0.0 110.283 178.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.503 HD13 HD21 ' A' ' 149' ' ' LEU . 76.6 mt -62.38 -42.64 99.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.756 176.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.523 ' HA ' HD21 ' A' ' 152' ' ' LEU . 41.4 ttm180 -56.27 -50.17 72.11 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.159 176.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.81 -37.09 70.7 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 123.487 0.492 . . . . 0.0 111.902 -177.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -68.11 -55.6 11.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.636 0.255 . . . . 0.0 110.816 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.534 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 84.2 m-85 -70.14 -29.69 66.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.917 0.389 . . . . 0.0 111.245 -177.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -67.48 -44.35 78.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.087 0.47 . . . . 0.0 110.595 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -84.68 -31.3 24.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.967 -172.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -108.74 110.83 22.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.263 0.554 . . . . 0.0 111.019 177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.48 -26.43 66.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.531 -177.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -58.94 -49.43 77.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.456 0.646 . . . . 0.0 109.837 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.05 -36.23 66.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.337 -175.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.534 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 1.6 ttp180 -65.34 -39.16 92.03 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.506 177.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.58 -45.07 95.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.979 175.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.557 HD22 ' HB1' ' A' ' 5' ' ' ALA . 61.5 tp -60.78 -47.14 87.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.611 177.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.529 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 53.2 tp -59.31 -50.51 73.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.184 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.511 HD13 ' HG3' ' A' ' 112' ' ' ARG . 9.5 mp -73.55 -11.31 60.4 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.05 -21.19 33.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.589 0.233 . . . . 0.0 111.194 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 77.6 p -82.66 -21.56 34.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.932 0.396 . . . . 0.0 110.861 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.513 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -59.71 141.48 88.82 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.185 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.7 Cg_endo -100.08 41.33 3.83 Favored 'Cis proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.222 -1.158 . . . . 0.0 113.676 1.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.51 165.3 24.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.827 0.346 . . . . 0.0 110.644 177.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.518 ' HB2' HD13 ' A' ' 16' ' ' ILE . 65.8 mttt -94.8 125.34 39.39 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.251 0.548 . . . . 0.0 111.343 -177.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 62.5 mt -86.64 101.35 13.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.185 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 87.0 t -116.1 106.55 20.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.351 -179.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -75.68 119.66 20.0 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 175.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -88.78 77.49 7.83 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.634 0.731 . . . . 0.0 109.153 -176.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.446 ' HB ' ' HA3' ' A' ' 134' ' ' GLY . 22.5 m -96.82 105.64 17.8 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.295 176.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -98.89 -9.23 24.47 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.727 -172.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' A' ' 130' ' ' ASP . 28.2 t-20 -96.52 96.55 8.75 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 129' ' ' ASN . 5.6 m-20 69.69 154.44 0.12 Allowed 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.985 0.803 . . . . 0.0 111.214 -172.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.413 ' HB1' ' HA3' ' A' ' 141' ' ' GLY . . . -99.54 85.6 3.18 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.35 0.595 . . . . 0.0 109.478 173.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.548 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 63.6 t80 -134.97 102.29 5.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.145 -178.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.737 ' HB3' HD22 ' A' ' 145' ' ' LEU . 78.5 m95 63.53 17.6 10.48 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.845 0.716 . . . . 0.0 110.209 -172.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.446 ' HA3' ' HB ' ' A' ' 127' ' ' THR . . . -148.46 155.76 26.56 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.528 ' CG ' ' HB2' ' A' ' 143' ' ' ASN . 2.9 m-20 -88.68 34.44 0.77 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -170.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 59.18 21.33 53.14 Favored Glycine 0 C--O 1.228 -0.28 0 C-N-CA 121.187 -0.53 . . . . 0.0 112.523 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 79.08 -53.11 4.11 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.68 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -67.91 -31.41 71.16 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.646 0.609 . . . . 0.0 112.646 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 119.83 42.15 0.54 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.996 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.5 tttt -172.77 87.32 0.07 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 174.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.413 ' HA3' ' HB1' ' A' ' 131' ' ' ALA . . . -152.74 -64.75 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 119.586 -1.292 . . . . 0.0 113.398 173.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.548 ' HD2' ' HA ' ' A' ' 132' ' ' TYR . 58.0 mttp -164.14 43.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.879 0.34 . . . . 0.0 111.029 -174.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.528 ' HB2' ' CG ' ' A' ' 135' ' ' ASP . 4.0 t-20 -61.1 4.95 0.07 Allowed 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 177.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.559 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 32.2 mtp180 -58.39 -24.13 59.11 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 122.167 -0.333 . . . . 0.0 110.916 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.737 HD22 ' HB3' ' A' ' 133' ' ' TRP . 47.5 tp -61.95 -50.67 71.19 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.006 0.431 . . . . 0.0 110.046 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.633 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -64.75 -32.82 85.47 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.545 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -65.44 -40.92 93.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.807 0.337 . . . . 0.0 110.437 176.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.0 mt -62.12 -38.7 89.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.004 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.503 HD21 HD13 ' A' ' 101' ' ' LEU . 77.8 mt -63.31 -36.93 85.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.82 176.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.633 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 60.8 mtt -61.73 -51.94 66.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.0 0.428 . . . . 0.0 110.128 177.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -63.37 -43.07 98.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.279 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.523 HD21 ' HA ' ' A' ' 102' ' ' ARG . 65.6 tp -61.37 -46.43 90.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.992 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.529 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 29.4 ttp85 -59.16 -39.45 82.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.713 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -65.3 -42.78 92.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.123 0.487 . . . . 0.0 110.106 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -63.59 -39.77 95.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.282 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.507 HD13 ' HD3' ' A' ' 112' ' ' ARG . 67.2 mt -78.9 -12.8 60.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.981 0.419 . . . . 0.0 110.516 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.494 ' HA ' HD21 ' A' ' 116' ' ' LEU . . . -78.66 -33.82 46.79 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.8 173.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.435 ' O ' ' HG3' ' A' ' 162' ' ' GLU . 1.4 mp -56.9 -38.28 58.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.835 177.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -63.42 -34.79 78.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.892 0.377 . . . . 0.0 110.46 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -72.79 -25.27 61.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.695 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.52 -23.72 61.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.878 0.37 . . . . 0.0 110.395 175.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 158' ' ' ILE . 46.0 mt-10 . . . . . 0 C--N 1.331 -0.223 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.376 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.4 t . . . . . 0 N--CA 1.465 0.298 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 61.8 mtm-85 -81.6 48.75 1.22 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.573 0.701 . . . . 0.0 110.977 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.449 ' HB1' HD13 ' A' ' 114' ' ' LEU . . . -85.63 -174.29 5.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.483 174.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 . . . . . 0 N--CA 1.463 0.194 0 O-C-N 123.13 0.269 . . . . 0.0 110.883 -179.141 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.8 m -84.98 -178.06 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.06 0.457 . . . . 0.0 110.799 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.4 mtm -100.28 165.83 11.28 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.844 -178.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.99 112.18 3.71 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 175.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 64.84 83.06 0.17 Allowed 'General case' 0 C--N 1.331 -0.231 0 O-C-N 123.943 0.777 . . . . 0.0 110.598 -174.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.475 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 31.7 m -115.12 120.49 39.95 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.398 177.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.423 HG12 ' HB3' ' A' ' 122' ' ' LYS . 31.6 mt -96.98 107.16 19.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.325 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.6 mt -101.64 101.14 11.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.706 -175.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.524 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 38.0 m-80 -87.3 105.02 16.95 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.529 175.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -110.77 166.77 10.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.33 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -150.12 122.9 8.66 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.538 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 81.2 p 56.57 -176.57 0.05 Allowed 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.0 0.92 . . . . 0.0 111.941 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.571 HG22 ' HA ' ' A' ' 28' ' ' ASP . 40.6 p -80.86 -27.84 36.25 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -172.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.5 p 50.98 -90.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.787 0.835 . . . . 0.0 112.045 -177.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -107.56 -93.3 0.4 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -131.95 0.48 3.87 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.018 0.437 . . . . 0.0 110.77 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -101.26 -13.85 17.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.103 0.478 . . . . 0.0 110.986 -176.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.492 ' C ' ' HA ' ' A' ' 22' ' ' THR . . . -94.08 0.24 66.46 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.126 -175.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.571 ' HA ' HG22 ' A' ' 22' ' ' THR . 36.3 m-20 -62.11 0.95 0.35 Allowed 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -174.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -62.3 -31.22 71.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.759 0.314 . . . . 0.0 110.25 171.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 74.7 m -58.48 153.15 16.52 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.511 0.672 . . . . 0.0 112.335 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 47' ' ' SER . 94.5 m-20 -76.85 -16.45 59.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.716 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -86.42 6.28 30.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.031 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.432 ' HB1' ' HD1' ' A' ' 35' ' ' TRP . . . -59.0 146.17 39.17 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.844 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.559 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -91.21 21.1 4.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.683 -173.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.465 ' HE1' ' CG ' ' A' ' 28' ' ' ASP . 77.4 m95 -89.85 124.85 62.67 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-O 120.713 0.292 . . . . 0.0 110.959 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.443 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 36.6 Cg_endo -66.71 128.59 19.26 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.554 2.169 . . . . 0.0 111.931 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.627 HG22 ' HA ' ' A' ' 104' ' ' LYS . 16.0 pt -103.12 137.75 30.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.915 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.466 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 43.4 tptt -100.2 101.18 12.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.057 -178.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.433 ' O ' ' HB3' ' A' ' 40' ' ' ASP . 42.1 t -115.63 125.03 72.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.469 -178.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.433 ' HB3' ' O ' ' A' ' 39' ' ' VAL . 20.6 t70 74.96 -62.67 0.45 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.363 1.078 . . . . 0.0 110.174 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.31 28.69 0.04 OUTLIER Glycine 0 C--N 1.298 -1.53 0 CA-C-N 113.3 -1.773 . . . . 0.0 109.928 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.1 mttp -135.39 142.01 45.6 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -172.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.9 m -102.09 106.42 17.3 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.764 -175.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.479 ' HB2' HG13 ' A' ' 37' ' ' ILE . 49.4 m95 -93.25 122.34 63.4 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.587 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 44' ' ' TRP . 4.4 Cg_endo -48.26 -36.31 29.24 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.698 2.932 . . . . 0.0 114.007 -175.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.559 HG22 ' HA ' ' A' ' 34' ' ' ALA . 55.2 p -148.3 166.22 28.68 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.405 ' HB3' ' O ' ' A' ' 31' ' ' ASN . 22.9 t -63.41 -39.88 95.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.589 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.65 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 5.0 mm-40 -57.64 -37.64 73.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.834 178.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.415 ' CG ' ' HG2' ' A' ' 45' ' ' PRO . 25.7 m80 -60.93 -43.87 98.02 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.551 0.215 . . . . 0.0 111.332 -178.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -68.49 -38.83 81.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.887 0.375 . . . . 0.0 110.683 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -62.71 -45.76 91.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.616 -179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.65 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 53.0 mm-40 -70.06 -33.91 72.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.749 -178.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.34 -44.61 82.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.426 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -81.62 -12.04 58.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.309 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.585 ' HE3' ' HA ' ' A' ' 79' ' ' ARG . 51.1 tttm -65.95 -28.34 68.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.708 175.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.624 ' CE1' ' HB2' ' A' ' 83' ' ' LYS . 96.3 m-85 -110.71 166.5 10.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.182 0.515 . . . . 0.0 111.185 -178.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.627 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.2 pt? -123.25 2.71 9.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.438 175.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -76.27 138.59 40.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.649 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -62.92 -56.15 19.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.562 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -58.84 -47.56 84.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.986 -173.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.488 ' CE2' ' HG3' ' A' ' 83' ' ' LYS . 0.5 OUTLIER -72.67 -41.19 65.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.089 -172.936 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -66.36 -30.97 71.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.433 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.408 ' CD ' HH21 ' A' ' 66' ' ' ARG . 14.1 tp10 -62.93 -47.48 83.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.037 174.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -61.63 -52.59 63.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.413 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.422 HG21 ' HB2' ' A' ' 52' ' ' GLN . 65.1 mt -63.32 -27.73 43.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.682 -175.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.408 HH21 ' CD ' ' A' ' 63' ' ' GLU . 46.4 ttp180 -73.49 -34.08 65.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.762 0.315 . . . . 0.0 111.346 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -99.14 -16.62 18.54 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -173.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.98 127.93 32.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.887 0.375 . . . . 0.0 110.057 178.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 p -85.12 -35.43 21.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.772 0.32 . . . . 0.0 110.935 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.476 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 15.5 m -58.61 116.19 14.33 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.616 -178.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 10.1 Cg_exo -71.99 -44.26 0.97 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.013 2.475 . . . . 0.0 112.529 -178.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.448 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 13.7 tpt -63.55 -42.92 98.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.413 -177.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 64.9 t -65.49 -41.15 90.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.901 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.8 -44.68 90.83 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.312 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.09 -34.81 64.1 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.978 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 72' ' ' MET . 0.7 OUTLIER -65.21 -45.9 82.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.171 -176.825 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -94.14 -2.04 53.3 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.009 0.433 . . . . 0.0 110.423 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.57 -51.26 4.39 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.298 -178.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.585 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 84.5 mtm-85 -82.68 25.3 0.66 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.33 0.586 . . . . 0.0 110.747 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -73.57 157.75 36.11 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.454 174.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 52.2 mtm180 -122.89 8.7 9.36 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.1 m -68.67 -28.04 66.51 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 170.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.624 ' HB2' ' CE1' ' A' ' 56' ' ' PHE . 25.5 mmtm -94.49 154.41 40.19 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.908 177.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.56 171.8 14.65 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.492 2.128 . . . . 0.0 112.791 -177.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 93.8 mt -126.94 173.41 9.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.309 0.576 . . . . 0.0 111.314 -178.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -84.28 152.73 23.98 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.022 177.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -78.89 -29.43 44.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.434 0.635 . . . . 0.0 109.76 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 22.3 p30 -92.18 13.53 18.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.604 176.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.596 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 42.5 t-105 -57.72 -29.58 64.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.55 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.558 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 28.8 mm-40 -63.92 -37.58 87.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.319 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.3 t -90.35 -20.82 22.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.773 0.32 . . . . 0.0 111.837 -174.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.53 ' HA ' ' HB3' ' A' ' 95' ' ' GLN . 34.1 m -101.41 -6.05 9.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -170.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.596 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 57.3 mttp -52.62 -65.02 0.63 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.524 0.678 . . . . 0.0 110.752 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.661 ' OE2' ' HD3' ' A' ' 144' ' ' ARG . 34.9 mt-10 -86.75 -5.06 59.23 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.84 -175.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.53 ' HB3' ' HA ' ' A' ' 92' ' ' VAL . 8.6 tt0 -80.98 -47.36 13.74 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.489 175.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 53.3 t -65.9 -38.21 81.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.35 176.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.761 ' HG3' ' CH2' ' A' ' 133' ' ' TRP . 1.0 OUTLIER -61.81 -43.79 98.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.07 177.655 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -56.46 -44.93 81.0 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.175 0.512 . . . . 0.0 110.304 175.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -62.56 -43.39 98.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.562 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.83 80.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.139 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 97' ' ' MET . 69.2 mt -63.3 -43.57 97.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.585 177.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.45 ' HA ' HD21 ' A' ' 152' ' ' LEU . 76.5 ttt180 -62.79 -42.89 99.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.035 177.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.671 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -59.02 -45.3 91.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.609 177.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.627 ' HA ' HG22 ' A' ' 37' ' ' ILE . 37.2 ttmt -56.38 -58.84 6.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.297 -179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.433 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 91.7 m-85 -80.09 -42.56 23.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -172.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -74.83 -22.51 58.66 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.982 -0.449 . . . . 0.0 111.497 -172.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.671 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.2 OUTLIER -83.5 -37.72 22.72 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.923 176.224 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.413 ' CE1' ' HE3' ' A' ' 35' ' ' TRP . 78.6 m-70 -98.36 104.56 16.61 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.77 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.79 -30.0 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.67 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.438 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.4 mp0 -56.33 -52.04 66.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.543 0.687 . . . . 0.0 110.008 176.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 40.0 mt -78.87 -31.47 45.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.442 -176.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.776 ' HG3' HD13 ' A' ' 156' ' ' LEU . 18.9 ttt180 -63.03 -43.88 97.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.128 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.34 -35.64 78.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.444 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.449 HD13 ' HB1' ' A' ' 5' ' ' ALA . 36.1 tp -64.82 -42.82 94.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.404 178.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.53 HD23 HD12 ' A' ' 156' ' ' LEU . 61.0 tp -62.36 -41.2 98.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.209 0.528 . . . . 0.0 110.726 178.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 87.1 mt -77.7 -14.12 59.7 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.976 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -81.1 -34.61 32.48 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.544 176.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 22.9 p -75.14 -11.92 60.19 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.213 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -57.38 134.59 81.6 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.502 174.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.2 Cg_endo -106.24 69.37 0.23 Allowed 'Cis proline' 0 C--N 1.354 0.817 0 CA-C-N 118.917 0.649 . . . . 0.0 113.112 -5.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -88.85 158.4 18.12 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.423 ' HB3' HG12 ' A' ' 16' ' ' ILE . 20.8 ttmm -88.19 105.95 17.87 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 176.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 29.5 mt -81.09 119.14 23.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.126 -173.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.524 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 47.3 t -134.95 123.6 41.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.9 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -98.85 137.09 37.92 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 172.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.418 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 81.1 t60 -98.91 77.56 2.22 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -177.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 5.7 t -100.01 94.98 6.55 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 122.298 1.047 . . . . 0.0 111.649 -173.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.505 ' HB3' ' HA3' ' A' ' 137' ' ' GLY . 3.0 pt-20 -83.27 14.36 3.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.894 170.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -82.37 -51.92 7.4 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.489 -1.232 . . . . 0.0 108.886 173.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -144.46 108.38 4.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.804 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.3 85.91 4.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.996 0.427 . . . . 0.0 111.182 -177.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.58 ' O ' ' HB3' ' A' ' 142' ' ' LYS . 35.5 t80 -169.17 -28.41 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.659 177.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.776 ' HB3' HD22 ' A' ' 145' ' ' LEU . 47.3 m95 -111.8 77.22 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.529 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 112.39 -140.43 16.23 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 -178.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.403 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 6.2 t0 -86.53 133.02 33.77 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 117.03 0.415 . . . . 0.0 110.222 176.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -84.55 32.33 3.4 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.127 -0.559 . . . . 0.0 112.804 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.505 ' HA3' ' HB3' ' A' ' 128' ' ' GLU . . . 80.95 13.45 81.2 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 121.185 -0.531 . . . . 0.0 114.091 174.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -154.35 12.15 0.41 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.955 0.877 . . . . 0.0 112.744 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 98.86 5.37 56.55 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 121.042 -0.599 . . . . 0.0 114.096 172.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -167.32 97.27 0.5 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 117.257 0.529 . . . . 0.0 111.253 176.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.33 -64.91 0.2 Allowed Glycine 0 C--N 1.31 -0.863 0 C-N-CA 120.481 -0.866 . . . . 0.0 111.332 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 132' ' ' TYR . 37.6 tttm -177.96 83.86 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.27 5.28 0.57 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.187 -174.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.661 ' HD3' ' OE2' ' A' ' 94' ' ' GLU . 51.2 ttt180 -62.48 -24.13 67.3 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -175.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.776 HD22 ' HB3' ' A' ' 133' ' ' TRP . 31.1 tp -58.57 -50.77 72.6 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 175.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.585 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -66.52 -28.62 73.84 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.925 176.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -68.78 -38.7 80.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.755 0.312 . . . . 0.0 110.328 177.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 96.3 mt -61.16 -37.55 83.28 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 174.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 153' ' ' ARG . 96.0 mt -64.9 -37.88 89.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.511 176.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.585 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 58.2 mtt -63.0 -51.77 65.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.875 0.369 . . . . 0.0 110.166 176.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -59.11 -44.41 91.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.459 -178.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 55.7 tp -67.11 -40.24 86.83 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.009 178.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.828 HH11 ' HB3' ' A' ' 153' ' ' ARG . 1.4 ttp-105 -57.8 -43.56 85.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.465 -179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.18 -46.42 82.84 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.278 175.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.0 -51.39 69.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.518 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.776 HD13 ' HG3' ' A' ' 112' ' ' ARG . 20.9 mt -63.33 -30.78 71.85 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.909 -175.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -69.0 -48.15 63.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.324 175.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.552 ' O ' ' HG3' ' A' ' 162' ' ' GLU . 81.7 mt -64.01 -39.05 84.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.202 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -56.11 -47.21 78.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.978 0.418 . . . . 0.0 110.552 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -84.05 -15.95 45.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.117 0.484 . . . . 0.0 110.418 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 14.4 tp -72.38 -19.06 61.68 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 175.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.552 ' HG3' ' O ' ' A' ' 158' ' ' ILE . 42.0 mt-10 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.998 176.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 20.4 t . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -87.39 101.03 13.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.887 0.375 . . . . 0.0 111.013 -173.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.78 124.88 30.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.263 177.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 . . . . . 0 C--N 1.326 -0.445 0 CA-C-O 120.755 0.312 . . . . 0.0 110.362 -178.805 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.1 m170 . . . . . 0 N--CA 1.462 0.158 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.429 HG21 ' HD2' ' A' ' 120' ' ' PRO . 29.1 m -83.46 15.27 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.727 -173.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 38.5 mtm 63.94 40.9 6.98 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.537 171.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 70.43 -69.4 0.18 Allowed 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.709 0.631 . . . . 0.0 111.733 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -140.18 87.78 2.17 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.61 -174.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.4 t -101.65 142.08 33.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.119 176.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.422 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.0 mp -96.15 105.61 17.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.4 mt -89.85 115.26 29.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.034 0.445 . . . . 0.0 110.347 -175.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.461 HD22 ' N ' ' A' ' 18' ' ' ASN . 0.9 OUTLIER -93.93 108.68 20.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.43 -177.22 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 31.4 p90 -114.25 113.79 25.09 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.086 0.47 . . . . 0.0 110.394 177.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.512 ' O ' ' HB2' ' A' ' 21' ' ' SER . 16.9 t80 -150.17 100.22 2.88 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 174.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 33.8 t 161.34 115.58 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.23 0 O-C-N 124.205 0.941 . . . . 0.0 109.008 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 m -87.94 2.47 51.56 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.241 0.543 . . . . 0.0 110.245 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.9 m -110.1 20.03 18.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.05 -177.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -126.29 157.63 37.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.966 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.91 -33.06 74.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.868 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -87.62 -1.52 58.01 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.6 0.714 . . . . 0.0 109.86 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.25 -0.29 56.61 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.261 -177.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -51.69 -30.74 23.28 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -72.9 -0.79 14.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.734 0.302 . . . . 0.0 111.701 -177.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.9 t -75.06 139.78 43.05 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -77.63 -3.2 39.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.004 0.431 . . . . 0.0 110.573 178.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -106.77 12.01 29.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.37 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.2 137.14 57.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.855 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.94 58.18 2.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.297 0.57 . . . . 0.0 111.595 -174.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.417 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 95.9 m95 -112.0 118.81 45.62 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.966 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 35' ' ' TRP . 36.9 Cg_endo -66.78 134.53 35.2 Favored 'Trans proline' 0 C--O 1.239 0.534 0 C-N-CA 122.624 2.216 . . . . 0.0 111.501 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.548 HG22 ' HA ' ' A' ' 104' ' ' LYS . 29.8 pt -121.85 155.84 26.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.101 0.477 . . . . 0.0 110.925 -176.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.596 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 1.2 tmtp? -117.31 107.07 13.95 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 -178.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.4 ' C ' ' H ' ' A' ' 41' ' ' GLY . 7.7 t -127.21 127.88 69.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.072 -173.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 27.6 t70 73.64 -19.94 0.32 Allowed 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.712 0.633 . . . . 0.0 111.84 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.539 ' HA2' ' HE2' ' A' ' 38' ' ' LYS . . . 125.79 1.86 7.47 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 -171.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -109.52 134.98 51.25 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.241 -0.48 . . . . 0.0 110.1 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.3 m -84.17 116.5 22.95 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.167 176.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.48 ' HB2' HG13 ' A' ' 37' ' ' ILE . 80.0 m95 -106.06 130.74 22.51 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.837 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.65 -26.16 69.02 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.695 2.263 . . . . 0.0 112.945 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.81 ' HB ' ' OE1' ' A' ' 48' ' ' GLU . 0.1 OUTLIER -159.71 173.7 15.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.329 -178.044 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.0 m -77.87 -48.34 16.65 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -171.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.81 ' OE1' ' HB ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -59.94 -25.97 65.59 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.178 -178.844 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.493 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 54.3 m80 -59.82 -43.4 94.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.005 176.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -67.22 -44.69 78.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.945 0.402 . . . . 0.0 110.074 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -60.87 -46.59 90.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.638 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.47 ' CG ' ' HA3' ' A' ' 78' ' ' GLY . 2.4 tp-100 -65.08 -32.4 74.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.809 -177.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.408 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -73.74 -46.06 48.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.53 -178.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -77.83 -9.54 59.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.181 0.515 . . . . 0.0 110.756 -177.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.413 ' HA ' ' CZ3' ' A' ' 89' ' ' TRP . 86.8 tttt -63.43 -29.17 70.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.045 175.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -109.17 167.09 10.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.78 -177.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.444 HD11 ' HG2' ' A' ' 86' ' ' ARG . 5.2 mp -96.57 -37.19 10.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.934 -176.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.556 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 24.5 t70 -63.38 126.63 28.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.822 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.63 -32.37 67.88 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -173.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.8 ttpp -64.35 -40.9 96.77 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.479 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 0.5 OUTLIER -66.45 -32.25 73.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.712 -179.628 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.556 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 65.0 mtt180 -63.67 -45.2 91.21 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.368 0.604 . . . . 0.0 109.556 176.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -77.59 -16.36 58.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.386 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.479 ' HB2' ' HA ' ' A' ' 61' ' ' TYR . 6.3 tp10 -66.82 -45.81 77.13 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.53 ' O ' HG12 ' A' ' 68' ' ' VAL . 1.9 mp -70.79 -31.4 45.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.731 175.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.4 ' HG2' ' O ' ' A' ' 66' ' ' ARG . 70.8 ttt180 -72.57 -11.54 60.69 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.009 0.433 . . . . 0.0 110.644 175.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -85.24 -7.95 58.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.132 0.491 . . . . 0.0 110.402 -177.901 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.56 HG21 ' HB ' ' A' ' 73' ' ' VAL . 7.5 p -115.36 138.43 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.792 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 39.3 t -90.35 -32.41 16.48 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.798 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.457 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 31.4 t -68.71 121.41 81.06 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.708 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.493 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 22.4 Cg_exo -66.05 -32.83 43.15 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.121 2.547 . . . . 0.0 112.26 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 46.3 ttm -67.8 -41.44 83.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.696 -177.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.56 ' HB ' HG21 ' A' ' 68' ' ' VAL . 87.1 t -66.3 -36.2 76.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.447 178.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.43 -44.28 95.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.247 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.417 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -63.44 -39.43 94.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.73 177.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -56.51 -53.84 52.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.693 178.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 54.0 mtm -70.56 -30.54 67.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.914 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.47 ' HA3' ' CG ' ' A' ' 52' ' ' GLN . . . -81.95 -7.22 88.19 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.943 -178.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 40.9 ttt180 -89.24 -0.94 57.85 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 122.539 -0.389 . . . . 0.0 110.627 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.443 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 30.2 t70 -71.12 112.38 7.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.047 0.451 . . . . 0.0 110.499 -179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -96.16 10.82 36.5 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.325 0.583 . . . . 0.0 110.16 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 m -74.13 -24.4 59.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.643 176.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.443 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 49.2 mmtm -75.78 147.0 80.62 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.576 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -62.51 120.58 8.18 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.319 2.013 . . . . 0.0 111.215 173.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 89.4 mt -86.74 150.95 23.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.804 -176.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.572 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 22.7 mtp180 -68.83 130.63 43.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.36 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -58.06 -43.09 86.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.976 0.417 . . . . 0.0 111.603 -177.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -103.32 33.23 3.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.835 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.572 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 43.8 t-105 -60.09 -40.11 88.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.776 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.477 ' HA ' ' HE3' ' A' ' 93' ' ' LYS . 12.4 pt-20 -68.23 -23.38 64.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.697 0.284 . . . . 0.0 111.211 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.0 m -84.38 -20.15 32.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.15 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.6 m -114.3 6.99 7.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 110.607 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.477 ' HE3' ' HA ' ' A' ' 90' ' ' GLU . 38.4 ttmt -58.78 -53.01 63.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.649 -176.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -25.5 49.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.469 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.823 ' HA ' ' HD2' ' A' ' 98' ' ' ARG . 34.0 tt0 -58.68 -56.06 27.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.631 174.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.9 -43.99 96.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.823 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 47.0 ttm -65.05 -43.92 90.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.774 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.823 ' HD2' ' HA ' ' A' ' 95' ' ' GLN . 0.8 OUTLIER -66.65 -29.32 69.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.441 -178.535 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.446 ' N ' ' HG2' ' A' ' 98' ' ' ARG . 88.3 tttt -71.12 -42.79 68.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.021 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.62 87.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.428 176.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.407 ' HA ' HD23 ' A' ' 101' ' ' LEU . 22.4 mt -60.91 -41.76 96.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.227 178.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.705 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 58.4 ttt180 -61.01 -48.65 80.83 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 120.383 -0.527 . . . . 0.0 109.882 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -55.9 -36.69 67.94 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.115 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.548 ' HA ' HG22 ' A' ' 37' ' ' ILE . 63.5 tttm -59.21 -50.61 73.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.171 178.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -81.79 -26.21 34.6 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -177.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.705 ' HG3' ' HG2' ' A' ' 102' ' ' ARG . 5.9 mm-40 -74.98 -35.79 62.04 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.729 0.3 . . . . 0.0 111.759 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.596 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 77.2 mm-40 -84.21 -11.46 56.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.985 0.422 . . . . 0.0 110.905 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -129.2 99.21 5.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.811 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -59.67 -29.9 68.39 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.486 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.9 mp0 -53.26 -51.79 61.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.074 175.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 29.0 mt -75.42 -33.7 60.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.48 -176.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 24.6 ttt-85 -57.96 -41.77 83.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.114 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.7 -43.12 73.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.792 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 63.7 tp -57.11 -44.28 83.11 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.784 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.441 HD23 HD12 ' A' ' 156' ' ' LEU . 40.5 tp -62.76 -45.89 90.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.274 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 156' ' ' LEU . 79.0 mt -70.37 -18.28 63.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.719 0.295 . . . . 0.0 111.629 -176.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -73.9 -21.9 59.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.631 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.1 p -75.67 -27.28 58.26 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -176.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.518 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -48.78 137.78 12.76 Favored Pre-proline 0 N--CA 1.467 0.379 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.429 ' HD2' HG21 ' A' ' 11' ' ' VAL . 94.5 Cg_endo -100.75 33.74 8.3 Favored 'Cis proline' 0 N--CA 1.458 -0.588 0 C-N-CA 124.554 -1.019 . . . . 0.0 112.941 -2.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -62.84 159.42 16.65 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.976 0.417 . . . . 0.0 111.688 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -90.5 119.05 30.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.114 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.416 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 60.5 mt -86.4 113.48 22.39 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.757 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 95.7 t -131.9 126.8 57.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.084 0.469 . . . . 0.0 111.285 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.568 ' OE1' ' HA3' ' A' ' 134' ' ' GLY . 0.0 OUTLIER -83.31 141.73 31.6 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 172.777 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -120.04 77.51 1.25 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.374 -174.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 2.2 m -78.33 137.49 38.08 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.601 171.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 45.6 mp0 -120.49 -1.36 10.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.74 0.305 . . . . 0.0 110.658 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -94.57 -5.43 45.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.885 0.374 . . . . 0.0 111.297 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . 0.791 ' O ' ' HA2' ' A' ' 136' ' ' GLY . 4.8 t70 -178.48 -165.01 0.08 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.06 86.2 2.23 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.88 0.371 . . . . 0.0 110.133 175.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.549 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 4.7 t80 -155.13 122.29 5.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.584 -175.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.433 ' HZ2' ' HG2' ' A' ' 93' ' ' LYS . 28.8 m95 64.03 20.62 12.28 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.78 0.675 . . . . 0.0 112.513 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.568 ' HA3' ' OE1' ' A' ' 125' ' ' GLU . . . -176.01 -114.85 0.39 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.232 -0.985 . . . . 0.0 112.279 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -112.79 173.14 6.52 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 120.698 0.285 . . . . 0.0 110.794 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . 0.791 ' HA2' ' O ' ' A' ' 130' ' ' ASP . . . -120.95 21.11 8.42 Favored Glycine 0 N--CA 1.444 -0.821 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 175.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.6 44.12 4.99 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.425 -0.417 . . . . 0.0 113.26 178.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -174.15 -35.34 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 117.164 0.482 . . . . 0.0 112.207 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 131.01 36.41 0.35 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.893 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt 179.32 89.99 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.816 0.341 . . . . 0.0 110.804 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.589 ' O ' ' HG3' ' A' ' 142' ' ' LYS . . . -123.93 -65.13 0.2 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 119.664 -1.255 . . . . 0.0 112.124 174.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.589 ' HG3' ' O ' ' A' ' 141' ' ' GLY . 47.6 mttp -166.17 79.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 123.697 0.799 . . . . 0.0 109.2 177.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.1 4.99 2.32 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.511 -173.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.692 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 6.9 tpp180 -49.63 -38.64 32.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.226 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.56 -58.5 7.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.962 -178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.416 ' HA3' ' O ' ' A' ' 123' ' ' LEU . . . -62.49 -29.88 74.8 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.945 -0.645 . . . . 0.0 111.752 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . 0.437 ' O ' ' HG2' ' A' ' 151' ' ' GLU . 11.4 t80 -67.21 -40.67 86.45 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.1 mt -61.06 -41.49 96.7 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.895 0.379 . . . . 0.0 110.174 175.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.8 mt -61.15 -36.76 80.64 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.863 177.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 77.8 mtm -77.58 -34.78 53.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.972 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 147' ' ' TYR . 7.3 mm-40 -59.72 -48.26 82.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.457 0.646 . . . . 0.0 109.48 172.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.522 HD11 ' HG3' ' A' ' 102' ' ' ARG . 54.3 tp -64.56 -37.63 88.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.793 179.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.674 ' HG2' HH11 ' A' ' 153' ' ' ARG . 30.9 ttp85 -61.04 -41.34 96.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.988 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -67.28 -33.95 76.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.084 0.468 . . . . 0.0 110.461 176.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -65.32 -53.18 47.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.901 177.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.533 ' HB2' HD21 ' A' ' 116' ' ' LEU . 55.2 mt -68.0 -23.59 65.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.93 -175.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.518 ' O ' ' HB3' ' A' ' 160' ' ' LYS . . . -64.43 -48.81 73.92 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.494 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.08 -37.42 80.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.771 0.319 . . . . 0.0 110.616 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.69 -24.19 66.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.019 0.438 . . . . 0.0 110.725 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' A' ' 157' ' ' ALA . 53.3 tttp -68.1 -26.73 65.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.257 176.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.4 mp -78.64 -35.69 45.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.248 0.547 . . . . 0.0 109.935 176.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.435 -178.321 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.7 p . . . . . 0 CA--C 1.535 0.372 0 CA-C-O 121.902 0.858 . . . . 0.0 109.988 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.527 ' HB3' ' CG ' ' A' ' 25' ' ' ASP . 42.3 ttm105 -105.6 37.89 2.12 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.772 0.796 . . . . 0.0 110.195 -176.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.419 ' HB1' HD13 ' A' ' 114' ' ' LEU . . . -78.37 29.4 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.2 -176.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 . . . . . 0 C--N 1.326 -0.423 0 CA-C-O 120.785 0.326 . . . . 0.0 110.789 -179.741 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 . . . . . 0 N--CA 1.469 0.493 0 CA-C-O 121.332 0.587 . . . . 0.0 111.588 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.518 HG21 ' HB2' ' A' ' 121' ' ' ALA . 34.4 m -68.59 163.14 3.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.542 176.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.428 ' SD ' ' N ' ' A' ' 12' ' ' MET . 0.0 OUTLIER -81.2 -79.9 0.15 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.814 -173.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.0 tp60 -171.46 119.74 0.47 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.391 -0.822 . . . . 0.0 108.925 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.8 t70 59.58 88.11 0.08 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.596 0.713 . . . . 0.0 110.198 -172.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.54 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 9.2 m -134.44 117.02 15.82 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.582 -179.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.465 ' H ' HD12 ' A' ' 16' ' ' ILE . 4.2 mp -82.95 100.77 6.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.469 HD11 HG11 ' A' ' 11' ' ' VAL . 62.9 mt -89.81 108.75 19.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.266 -177.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.616 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 0.9 OUTLIER -92.81 106.64 18.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.598 179.436 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.648 ' CE2' ' HB2' ' A' ' 125' ' ' GLU . 39.6 p90 -105.02 151.33 24.08 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 174.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.671 ' CE1' ' HA ' ' A' ' 127' ' ' THR . 1.7 t80 -150.1 108.04 3.72 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.436 -0.505 . . . . 0.0 111.923 -176.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.7 m 73.68 171.14 0.3 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.614 0.721 . . . . 0.0 112.247 173.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.0 p -82.43 3.05 29.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.997 -1.001 . . . . 0.0 112.222 -172.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.7 p -76.12 23.39 0.14 Allowed 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -174.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -156.92 163.66 38.9 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 -178.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.527 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 5.7 m-20 -61.24 -35.71 77.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.264 0.554 . . . . 0.0 109.901 175.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.426 ' CE1' HD11 ' A' ' 114' ' ' LEU . 92.2 m-85 -77.74 -1.95 33.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.354 177.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.27 -4.15 67.8 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.08 177.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -68.78 -22.85 64.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.423 0.63 . . . . 0.0 110.093 174.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -68.5 -24.86 64.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.475 176.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.0 m -71.98 134.11 45.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.739 175.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -54.97 -23.63 20.14 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -174.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.62 -52.96 17.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 176.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 42.25 -157.2 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.863 0.865 . . . . 0.0 112.992 -176.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -157.86 22.63 0.27 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.737 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.422 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 84.1 m95 -112.99 125.58 29.58 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.935 -177.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 24.5 Cg_exo -64.38 143.24 82.04 Favored 'Trans proline' 0 C--O 1.238 0.485 0 C-N-CA 122.844 2.363 . . . . 0.0 112.41 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.652 HG22 ' HA ' ' A' ' 104' ' ' LYS . 32.2 pt -121.92 153.0 25.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.523 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.414 ' HE3' ' O ' ' A' ' 41' ' ' GLY . 37.9 tptt -116.17 95.43 5.08 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 t -107.81 117.42 53.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.291 -178.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.6 t70 69.13 5.01 4.84 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.584 0.707 . . . . 0.0 110.632 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.414 ' O ' ' HE3' ' A' ' 38' ' ' LYS . . . 104.67 -2.34 42.18 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.469 -175.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 51.6 mttm -94.25 125.45 38.89 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.66 ' HB ' HH21 ' A' ' 66' ' ' ARG . 35.2 m -82.82 109.72 17.21 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.863 0.363 . . . . 0.0 110.602 178.073 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.436 ' HB2' ' CG1' ' A' ' 37' ' ' ILE . 57.6 m95 -101.84 129.04 27.37 Favored Pre-proline 0 C--N 1.318 -0.773 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 174.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.472 ' CG ' ' HA ' ' A' ' 69' ' ' SER . 52.4 Cg_exo -53.78 -22.57 23.77 Favored 'Trans proline' 0 N--CA 1.475 0.431 0 C-N-CA 123.026 2.484 . . . . 0.0 113.338 -176.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 15.4 t -179.31 173.37 1.12 Allowed 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 175.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.73 -32.57 71.83 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -175.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -50.02 -43.37 50.68 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.559 0.343 . . . . 0.0 111.335 175.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -69.13 -30.13 68.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.168 -175.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -76.02 -31.65 59.0 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -64.02 -52.38 59.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.948 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -63.6 -41.03 98.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.653 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.784 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -67.04 -27.69 67.61 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -100.49 -7.15 24.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.657 0.265 . . . . 0.0 110.988 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.545 ' HA ' ' CZ3' ' A' ' 89' ' ' TRP . 83.2 tttt -62.62 -39.59 94.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.333 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -107.36 160.79 15.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.115 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.754 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.6 pt? -95.73 28.9 2.84 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 168.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -97.68 106.58 18.91 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.105 -1.407 . . . . 0.0 109.895 -176.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 2.4 mp0 -64.69 -35.8 82.2 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.346 -178.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -63.79 -47.6 80.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.797 0.332 . . . . 0.0 110.809 -177.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.552 ' O ' HG12 ' A' ' 65' ' ' ILE . 0.1 OUTLIER -68.77 -29.55 67.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.367 -178.145 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.784 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 38.4 ttm180 -60.99 -41.9 97.38 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.127 0.489 . . . . 0.0 109.754 176.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 45.0 mt-10 -65.7 -39.51 91.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.117 176.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.26 -36.99 63.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.154 -174.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 61' ' ' TYR . 41.1 mm -63.56 -33.47 61.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 174.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.66 HH21 ' HB ' ' A' ' 43' ' ' THR . 0.4 OUTLIER -73.25 -25.31 60.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.271 178.04 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 58.0 mtt-85 -70.28 -33.24 71.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.643 0.259 . . . . 0.0 111.204 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.4 m -92.29 134.88 29.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.239 0.542 . . . . 0.0 111.417 -175.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.472 ' HA ' ' CG ' ' A' ' 45' ' ' PRO . 5.0 p -88.78 -21.32 23.85 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.479 175.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 44.5 t -78.47 126.18 83.42 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.741 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -72.34 -32.29 10.46 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.636 2.224 . . . . 0.0 112.008 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.9 tpt -69.82 -38.36 76.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.266 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 95.5 t -68.32 -39.09 80.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.565 177.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.98 -52.2 57.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.658 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.14 -35.77 74.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.044 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 30.5 ttt85 -62.33 -39.98 94.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.742 0.306 . . . . 0.0 110.689 177.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 72.4 mtm -74.02 -34.93 64.32 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.03 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.49 6.37 77.74 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.469 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -63.25 -42.3 99.16 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -86.95 176.9 7.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.831 0.348 . . . . 0.0 111.482 -170.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -115.18 5.42 14.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.046 -174.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 49.9 m -64.75 -27.3 68.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.884 0.373 . . . . 0.0 111.294 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.498 ' HE3' ' CE2' ' A' ' 61' ' ' TYR . 0.2 OUTLIER -89.49 147.22 37.48 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -50.27 112.55 0.76 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.164 2.576 . . . . 0.0 113.97 -173.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 97.0 mt -88.47 155.17 19.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.023 175.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 -95.76 143.77 26.71 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.747 0.308 . . . . 0.0 110.497 -178.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -79.45 -28.64 41.62 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.177 0.513 . . . . 0.0 110.28 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -85.47 11.9 9.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.621 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.545 ' CZ3' ' HA ' ' A' ' 55' ' ' LYS . 60.7 t-105 -60.39 -19.45 55.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.333 0.587 . . . . 0.0 110.138 176.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.612 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 17.9 mm-40 -68.11 -40.38 82.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.488 175.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.0 p -100.02 -1.0 38.12 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -172.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.484 HG22 ' HA ' ' A' ' 89' ' ' TRP . 34.7 m -112.37 0.8 8.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -177.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.612 ' NZ ' ' HA ' ' A' ' 90' ' ' GLU . 50.7 mttp -61.04 -54.92 38.83 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.286 0.565 . . . . 0.0 109.944 179.497 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -67.74 -28.66 67.83 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.471 -178.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -69.94 -54.09 14.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.744 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.4 t -62.22 -43.99 98.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.636 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.09 -50.15 74.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.886 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.5 ttm-85 -60.01 -43.11 95.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.899 0.381 . . . . 0.0 110.866 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -66.48 -48.01 71.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.919 -178.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.11 -37.98 89.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.88 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.425 HD13 ' CD2' ' A' ' 149' ' ' LEU . 90.0 mt -67.5 -43.06 81.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.107 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.522 ' HG3' HD11 ' A' ' 152' ' ' LEU . 10.9 ttt-85 -61.55 -46.55 89.46 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.956 178.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -63.91 -24.48 67.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.097 -179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.652 ' HA ' HG22 ' A' ' 37' ' ' ILE . 28.1 ttpp -76.74 -49.6 15.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.547 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.595 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 77.4 m-85 -71.6 -27.55 63.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.327 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.431 ' HA ' HH11 ' A' ' 112' ' ' ARG . 25.6 mt-10 -73.83 -35.4 64.84 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.613 173.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.538 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 7.8 tp-100 -66.81 -34.66 78.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.061 -177.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.447 ' HB3' ' OE2' ' A' ' 110' ' ' GLU . 97.0 m-70 -121.4 109.59 15.06 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.459 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.76 -33.25 73.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.778 -177.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.0 OUTLIER -72.44 -29.9 64.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.77 -179.044 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 76.2 mt -74.61 -38.64 62.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.04 0.447 . . . . 0.0 109.893 175.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.595 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 30.6 ttp-105 -62.89 -43.53 98.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.045 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.69 72.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.722 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.426 HD11 ' CE1' ' A' ' 26' ' ' TYR . 66.4 tp -66.27 -48.17 71.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.943 0.401 . . . . 0.0 110.257 176.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.495 HD23 HD12 ' A' ' 156' ' ' LEU . 42.7 tp -59.41 -44.89 92.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.013 178.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 51.3 mt -74.94 -15.96 60.66 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.476 -177.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.3 -21.14 56.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.894 0.378 . . . . 0.0 110.752 176.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.417 ' O ' ' HB3' ' A' ' 121' ' ' ALA . 43.8 p -85.97 -5.95 59.13 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 121.05 0.453 . . . . 0.0 110.559 178.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.07 143.21 65.3 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.282 174.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -99.34 46.56 2.36 Favored 'Cis proline' 0 N--CA 1.456 -0.687 0 C-N-CA 124.397 -1.085 . . . . 0.0 113.56 -0.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.54 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -78.73 176.53 9.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.588 0.232 . . . . 0.0 110.761 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.413 ' HG3' ' SD ' ' A' ' 150' ' ' MET . 35.1 ttpt -108.69 127.82 54.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.271 -176.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 27.8 mt -93.16 120.46 33.48 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.27 -172.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 99.0 t -139.42 120.3 15.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.047 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.648 ' HB2' ' CE2' ' A' ' 19' ' ' PHE . 31.8 tt0 -93.88 129.86 40.15 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 172.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.501 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 8.4 t60 -97.63 77.6 2.58 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -176.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.671 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -77.17 92.22 3.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.065 -179.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.421 ' HB2' ' HD2' ' A' ' 126' ' ' HIS . 20.3 tt0 -95.53 -15.01 23.16 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.225 -174.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -88.61 -34.08 17.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.542 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . 0.543 ' O ' ' HB ' ' A' ' 127' ' ' THR . 34.3 t70 -142.19 110.28 5.93 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.101 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.524 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -79.09 85.94 4.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.919 -172.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.518 ' CE2' ' HD3' ' A' ' 142' ' ' LYS . 7.4 t80 -169.55 147.36 3.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.522 172.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.456 ' HB3' HD22 ' A' ' 145' ' ' LEU . 18.5 m95 68.53 13.6 8.97 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 123.746 0.654 . . . . 0.0 111.693 178.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -160.44 -155.59 7.83 Favored Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 119.929 -1.129 . . . . 0.0 112.71 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.501 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 15.3 t70 -66.43 -29.02 69.07 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.224 0.535 . . . . 0.0 110.696 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . 0.638 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 78.06 0.41 76.2 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.62 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.441 ' HA2' ' NE2' ' A' ' 126' ' ' HIS . . . 88.26 9.37 70.13 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.491 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -170.3 25.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 111.186 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 86.54 -51.97 4.41 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.288 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -88.67 65.25 7.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.3 0.572 . . . . 0.0 111.119 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.638 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -123.32 14.49 8.25 Favored Glycine 0 C--N 1.315 -0.616 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.379 173.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.518 ' HD3' ' CE2' ' A' ' 132' ' ' TYR . 22.2 mtpp 61.36 79.9 0.24 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.211 0.604 . . . . 0.0 111.071 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -75.38 5.33 5.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.276 -176.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.668 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 1.2 ttm180 -32.76 -37.42 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.43 1.092 . . . . 0.0 112.665 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.456 HD22 ' HB3' ' A' ' 133' ' ' TRP . 45.4 tp -61.37 -52.65 63.76 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.611 0.243 . . . . 0.0 111.126 -178.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -63.17 -27.01 69.88 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.701 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -71.33 -43.34 67.2 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.668 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 75.1 mt -61.71 -41.21 97.3 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 175.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.425 ' CD2' HD13 ' A' ' 101' ' ' LEU . 60.8 mt -61.3 -38.83 88.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.813 175.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.413 ' SD ' ' HG3' ' A' ' 122' ' ' LYS . 62.4 mtm -70.09 -38.95 75.82 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.212 178.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.0 -46.13 90.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.026 0.441 . . . . 0.0 109.887 174.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.522 HD11 ' HG3' ' A' ' 102' ' ' ARG . 45.7 tp -63.29 -42.06 99.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.642 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.938 HH11 ' HB3' ' A' ' 153' ' ' ARG . 1.0 OUTLIER -60.01 -42.49 94.39 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.672 176.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.63 -44.68 93.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.226 0.536 . . . . 0.0 109.858 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -65.12 -41.42 94.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.143 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.495 HD12 HD23 ' A' ' 115' ' ' LEU . 79.3 mt -76.28 -22.57 54.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.706 -0.225 . . . . 0.0 110.569 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -67.24 -44.37 79.63 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 172.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 75.2 mt -63.6 -40.12 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.876 174.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -63.52 -32.42 73.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.217 177.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -74.58 -44.07 52.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.795 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.12 -16.93 49.68 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.641 175.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.544 177.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.466 HG21 ' HB3' ' A' ' 110' ' ' GLU . 8.4 p . . . . . 0 N--CA 1.469 0.511 0 CA-C-O 122.285 1.041 . . . . 0.0 113.187 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -101.66 -31.91 10.58 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.889 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 56.0 68.79 0.81 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.513 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.432 178.604 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 120.693 0.282 . . . . 0.0 111.523 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.801 HG21 ' HD2' ' A' ' 120' ' ' PRO . 9.0 m -89.65 163.83 2.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 21.0 mtm -125.26 18.19 8.31 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.594 0.235 . . . . 0.0 110.791 -174.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.401 ' C ' ' H ' ' A' ' 15' ' ' THR . 27.1 mt-30 69.18 -60.21 0.46 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.168 -176.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -79.23 24.33 0.34 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.705 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.401 ' H ' ' C ' ' A' ' 13' ' ' GLN . 11.8 m -83.13 103.25 12.4 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.311 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.556 HG12 ' HB3' ' A' ' 122' ' ' LYS . 28.4 mt -100.88 108.73 23.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 175.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -92.35 111.6 24.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.413 -174.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.63 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 16.8 m120 -99.61 116.46 31.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.076 -178.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.455 ' O ' ' HG3' ' A' ' 125' ' ' GLU . 28.8 p90 -112.36 174.44 5.88 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.238 178.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -142.16 100.57 3.75 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.7 p 49.17 -144.39 0.46 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 123.778 0.674 . . . . 0.0 110.967 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.67 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 17.0 p -76.01 -77.16 0.14 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.45 -179.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.8 m 68.16 -61.09 0.4 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.107 0.563 . . . . 0.0 112.163 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.406 ' CG ' ' H ' ' A' ' 25' ' ' ASP . 9.5 t70 -132.04 -164.7 1.49 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -175.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.406 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 28.3 t70 -71.25 -20.05 62.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.458 0.647 . . . . 0.0 110.242 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -77.77 -5.66 51.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.505 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.67 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -71.28 -0.85 39.32 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.892 -0.595 . . . . 0.0 114.026 -174.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.41 -24.48 60.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.011 0.434 . . . . 0.0 111.658 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.401 ' HD2' HD23 ' A' ' 149' ' ' LEU . 69.8 m-85 -66.1 -13.3 59.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.431 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.2 t -86.56 131.78 34.08 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 174.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -75.5 8.7 2.64 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -176.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -98.52 4.2 48.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.366 0.603 . . . . 0.0 109.636 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.402 ' O ' HG22 ' A' ' 46' ' ' THR . . . -71.14 138.0 49.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.474 177.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.428 ' HA ' ' CG2' ' A' ' 46' ' ' THR . . . -86.35 60.65 6.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.18 0.514 . . . . 0.0 111.613 -173.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -101.95 113.05 65.97 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.12 175.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.84 132.83 44.41 Favored 'Trans proline' 0 C--O 1.239 0.531 0 C-N-CA 122.776 2.318 . . . . 0.0 112.35 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.511 HG13 ' HB2' ' A' ' 44' ' ' TRP . 12.4 pt -126.11 130.34 72.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.523 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -86.78 98.68 11.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.417 177.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.0 t -126.16 129.13 72.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.97 -174.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 59.68 20.63 9.31 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.812 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 108.46 -14.26 35.89 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.584 -0.817 . . . . 0.0 113.551 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.407 ' HD2' ' HA ' ' A' ' 42' ' ' LYS . 12.6 tptm -124.79 161.84 25.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 117.938 0.869 . . . . 0.0 110.922 -172.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.5 m -96.71 115.44 27.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.898 0.38 . . . . 0.0 110.604 -177.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.511 ' HB2' HG13 ' A' ' 37' ' ' ILE . 67.4 m95 -96.65 129.33 33.25 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.688 178.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 27.3 Cg_exo -64.43 -25.61 63.34 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 123.185 2.59 . . . . 0.0 113.082 -176.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.428 ' CG2' ' HA ' ' A' ' 34' ' ' ALA . 0.9 OUTLIER -155.38 162.05 40.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.092 -178.566 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.2 m -66.15 -36.93 84.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.591 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -23.1 62.62 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -175.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -62.94 -45.14 93.88 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.88 0.371 . . . . 0.0 110.461 175.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -70.1 -41.99 73.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.509 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -59.61 -44.31 93.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.662 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.647 ' HG3' ' HA3' ' A' ' 78' ' ' GLY . 0.0 OUTLIER -69.53 -36.16 76.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.691 0.282 . . . . 0.0 110.95 -179.857 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.424 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -70.17 -39.06 75.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.925 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -81.53 -18.93 43.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.871 0.367 . . . . 0.0 110.733 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -59.7 -31.63 69.77 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.027 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.448 ' CE1' ' HA2' ' A' ' 78' ' ' GLY . 88.8 m-85 -95.71 132.38 40.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.772 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 84' ' ' PRO . 0.5 OUTLIER -88.93 0.85 56.25 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.443 0.64 . . . . 0.0 109.681 170.639 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -84.96 111.04 19.33 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 170.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.575 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 40.5 mt-10 -77.31 -10.87 59.7 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.714 -172.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -73.57 -45.01 55.89 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -66.21 -38.26 87.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.58 172.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.424 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.2 ttp180 -61.03 -38.41 86.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.653 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.575 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 48.9 mm-40 -60.72 -48.15 83.08 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.386 174.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.18 -49.56 76.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.835 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 74.7 mt -64.15 -27.8 43.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.556 -176.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 66' ' ' ARG . 41.3 ttp-105 -77.11 -23.73 51.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.735 0.303 . . . . 0.0 111.259 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 23.8 mtm180 -93.71 -14.64 26.1 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -174.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.0 m -85.75 131.44 34.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.246 0.546 . . . . 0.0 111.069 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.1 t -87.97 -7.11 57.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.751 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.447 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.5 m -87.59 116.05 64.86 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.252 -177.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 16.9 Cg_exo -69.03 -51.41 0.45 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.037 2.492 . . . . 0.0 112.551 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 86.2 mtp -63.02 -38.62 91.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 111.044 -175.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 61.1 t -64.59 -39.07 84.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.486 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -51.05 55.17 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.643 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -57.91 -39.77 78.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.56 -178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -65.71 -53.72 37.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.68 0.276 . . . . 0.0 111.234 -177.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -76.14 -18.96 58.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.937 0.399 . . . . 0.0 110.699 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.647 ' HA3' ' HG3' ' A' ' 52' ' ' GLN . . . -83.22 -21.58 58.54 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.753 -0.737 . . . . 0.0 111.98 178.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.6 ttm105 -73.35 -9.22 58.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.149 0.5 . . . . 0.0 110.437 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.623 ' OD1' ' HG2' ' A' ' 83' ' ' LYS . 10.2 t70 -51.92 131.95 31.64 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.154 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.597 ' HD3' ' O ' ' A' ' 81' ' ' ARG . 4.5 tmt_? -112.46 -7.42 13.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.184 0.516 . . . . 0.0 110.073 -177.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.2 m -79.87 -19.02 49.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.189 0.518 . . . . 0.0 110.272 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.623 ' HG2' ' OD1' ' A' ' 80' ' ' ASP . 42.5 mmtm -75.1 161.94 75.26 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.375 176.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.537 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 32.0 Cg_endo -64.36 115.21 3.04 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.231 1.954 . . . . 0.0 111.991 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.426 HD11 ' HG2' ' A' ' 81' ' ' ARG . 96.0 mt -90.0 166.96 13.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.021 178.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -86.0 142.81 28.5 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -178.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -58.54 -48.5 80.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.397 . . . . 0.0 110.834 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -96.44 32.87 1.9 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.985 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.5 ' O ' ' HB2' ' A' ' 93' ' ' LYS . 19.2 t-105 -55.67 -44.08 76.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.028 -178.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.16 -18.94 64.0 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.007 0.432 . . . . 0.0 111.33 -177.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.0 m -90.14 -43.37 10.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.666 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.406 ' O ' HG23 ' A' ' 96' ' ' VAL . 33.2 m -79.16 -17.25 13.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.621 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.5 ' HB2' ' O ' ' A' ' 89' ' ' TRP . 21.4 tttp -50.49 -50.16 53.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.458 0.647 . . . . 0.0 110.279 176.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.464 ' H ' ' HG2' ' A' ' 94' ' ' GLU . 3.4 mm-40 -63.28 -38.23 90.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.676 -178.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -79.74 -42.2 25.08 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.515 -173.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 92' ' ' VAL . 94.7 t -61.62 -41.76 91.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.871 0.367 . . . . 0.0 110.115 177.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 49.0 tpp -62.44 -45.48 92.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.397 177.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 98' ' ' ARG . 17.2 ttm180 -63.85 -38.13 89.96 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.8 178.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -61.79 -44.99 95.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.76 0.314 . . . . 0.0 110.395 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.79 -44.98 79.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.723 177.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.403 HD13 HD12 ' A' ' 149' ' ' LEU . 75.7 mt -59.52 -49.54 77.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.194 178.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -59.77 -48.56 81.2 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.557 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.88 -39.07 73.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.958 0.409 . . . . 0.0 110.629 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.81 -46.4 58.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.253 -175.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -82.02 -38.53 24.89 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -76.97 -33.93 57.61 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 122.086 -0.384 . . . . 0.0 111.577 -173.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -83.83 -2.8 57.12 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.141 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.407 ' HB3' ' HG ' ' A' ' 111' ' ' LEU . 65.7 m-70 -126.4 100.25 6.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.463 177.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.4 -32.0 66.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.89 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.466 ' HB3' HG21 ' A' ' 3' ' ' VAL . 1.4 mp0 -56.64 -50.6 71.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.089 177.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.407 ' HG ' ' HB3' ' A' ' 108' ' ' HIS . 22.3 mt -76.73 -31.47 57.16 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.509 -173.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -59.15 -44.41 92.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.959 175.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.97 -46.85 89.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.655 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 56.5 tp -59.19 -47.81 83.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.848 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.433 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 48.9 tp -62.47 -50.58 70.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.479 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.539 HD11 ' HB2' ' A' ' 156' ' ' LEU . 10.6 mp -70.95 -13.33 61.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.918 -175.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.83 -22.78 60.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.762 -0.199 . . . . 0.0 111.241 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 47.5 p -78.72 -29.99 45.66 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.561 -177.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.497 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -51.29 136.57 30.46 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.801 ' HD2' HG21 ' A' ' 11' ' ' VAL . 85.4 Cg_endo -101.39 42.57 3.19 Favored 'Cis proline' 0 CA--C 1.537 0.642 0 C-N-CA 124.757 -0.934 . . . . 0.0 113.152 -3.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.98 159.11 34.37 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 122.167 -0.333 . . . . 0.0 110.973 178.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.556 ' HB3' HG12 ' A' ' 16' ' ' ILE . 35.5 ttmt -89.49 121.09 31.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.836 0.35 . . . . 0.0 110.487 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.404 HD12 ' HB3' ' A' ' 149' ' ' LEU . 70.1 mt -89.67 108.82 19.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.718 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.63 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 96.1 t -137.91 117.31 14.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.523 -179.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 19' ' ' PHE . 44.9 tt0 -89.4 110.62 21.41 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 173.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.484 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 86.1 t60 -82.44 77.33 9.23 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 98.8 m -92.05 99.14 12.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 174.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.457 ' HG3' ' HA3' ' A' ' 137' ' ' GLY . 19.7 tt0 -79.37 -15.94 57.07 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.139 -171.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.409 ' O ' ' HB2' ' A' ' 130' ' ' ASP . 12.9 m120 -101.68 112.27 24.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.329 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 129' ' ' ASN . 23.8 m-20 72.84 110.19 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.119 0.887 . . . . 0.0 111.392 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.448 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -86.42 94.15 9.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.83 -179.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -159.73 111.08 2.0 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 51.5 m95 70.08 8.13 6.53 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.392 0.677 . . . . 0.0 111.322 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -125.61 -160.48 10.68 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.484 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 0.8 OUTLIER -89.89 -14.08 35.01 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 118.257 1.028 . . . . 0.0 109.768 177.425 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 69.22 17.52 72.21 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.21 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.468 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 90.11 9.33 65.69 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 121.048 -0.596 . . . . 0.0 113.514 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -160.98 -37.75 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 117.593 0.696 . . . . 0.0 112.716 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 147.78 -48.54 0.63 Allowed Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.716 -179.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -76.11 58.68 1.24 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.58 0.705 . . . . 0.0 110.403 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.448 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -125.51 15.23 7.18 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 174.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.442 ' C ' ' H ' ' A' ' 144' ' ' ARG . 55.4 mttm 68.99 55.92 0.42 Allowed 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.732 -0.734 . . . . 0.0 111.411 -174.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -68.91 4.9 1.29 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.544 0.688 . . . . 0.0 109.747 173.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 0.0 OUTLIER -52.89 -17.3 1.33 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.174 176.156 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 55.7 tp -58.56 -58.34 8.97 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 169.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.622 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -59.77 -30.7 69.8 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.831 175.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -67.07 -40.8 87.09 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 177.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 89.0 mt -67.87 -33.92 75.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.901 0.381 . . . . 0.0 110.228 176.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.404 ' HB3' HD12 ' A' ' 123' ' ' LEU . 8.2 mp -59.62 -41.65 90.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.839 172.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.622 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 53.7 mtt -61.55 -52.0 66.27 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 175.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -47.69 -54.27 12.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.332 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 56.7 tp -68.93 -39.98 79.28 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.211 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.433 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 59.8 ttp180 -58.3 -50.31 74.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.814 -177.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . 0.617 ' HG2' ' O ' ' A' ' 150' ' ' MET . 14.7 mm-40 -59.98 -46.41 89.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.132 0.491 . . . . 0.0 110.177 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -59.53 -41.33 89.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.705 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.539 ' HB2' HD11 ' A' ' 116' ' ' LEU . 87.3 mt -77.17 -31.54 55.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.788 0.328 . . . . 0.0 110.846 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -64.27 -44.71 90.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.138 -179.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 154' ' ' GLU . 83.9 mt -57.25 -40.46 73.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.282 -179.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -80.14 -7.94 59.17 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.424 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -82.82 -26.93 31.25 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.27 -16.65 63.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.881 172.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.572 -178.773 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.4 t . . . . . 0 N--CA 1.45 -0.44 0 CA-C-O 121.32 0.581 . . . . 0.0 110.544 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -77.24 81.47 3.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.584 176.13 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.595 ' HA ' HD13 ' A' ' 114' ' ' LEU . . . -60.45 -56.1 25.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.56 -178.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 . . . . . 0 C--N 1.321 -0.636 0 CA-C-O 121.295 0.569 . . . . 0.0 110.943 -177.063 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.412 ' C ' ' H ' ' A' ' 12' ' ' MET . 2.1 m80 . . . . . 0 N--CA 1.452 -0.325 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.7 m -74.97 10.6 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.884 174.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.465 ' HB2' ' OG1' ' A' ' 15' ' ' THR . 57.3 mtm 69.09 -160.59 0.18 Allowed 'General case' 0 C--O 1.232 0.157 0 O-C-N 123.858 0.724 . . . . 0.0 109.9 -179.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -127.72 141.91 51.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -177.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 59.82 27.73 17.09 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.339 0.59 . . . . 0.0 110.713 -177.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.465 ' OG1' ' HB2' ' A' ' 12' ' ' MET . 96.8 m -92.7 124.09 36.46 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.168 -177.065 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mp -100.03 116.42 43.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.431 176.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 61.2 mt -89.86 96.73 6.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.416 0.627 . . . . 0.0 109.458 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -101.04 130.1 47.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.003 -177.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.0 p90 -132.1 177.33 7.65 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.091 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.51 103.99 5.02 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.419 177.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.1 m 63.02 -155.5 0.33 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.153 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.657 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 17.4 p -74.13 -16.0 61.02 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -177.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 m 47.67 -94.99 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 O-C-N 123.809 0.693 . . . . 0.0 111.34 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -162.46 115.27 1.69 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.581 174.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.1 t70 68.48 -68.95 0.16 Allowed 'General case' 0 N--CA 1.47 0.565 0 O-C-N 124.069 0.855 . . . . 0.0 112.321 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -78.37 -1.43 33.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.528 0.68 . . . . 0.0 111.087 -175.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.657 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -74.36 -0.24 56.91 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.361 175.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -46.27 -28.45 1.29 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.05 0.94 . . . . 0.0 112.955 -176.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -53.58 -38.69 64.16 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.583 0.23 . . . . 0.0 111.584 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 10.9 t -61.82 143.89 55.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.197 0.522 . . . . 0.0 110.819 -176.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -65.26 -31.57 72.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.001 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -77.51 9.99 2.92 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.303 0.573 . . . . 0.0 110.924 -176.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.78 142.56 46.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.661 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.55 62.23 4.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.592 0.71 . . . . 0.0 111.103 -175.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.447 ' CZ2' HD21 ' A' ' 111' ' ' LEU . 86.3 m95 -105.75 102.49 38.82 Favored Pre-proline 0 C--N 1.315 -0.895 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.041 173.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -56.91 131.0 42.83 Favored 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 122.903 2.402 . . . . 0.0 112.117 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.518 HG13 ' HB2' ' A' ' 44' ' ' TRP . 18.3 pt -122.32 126.33 74.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.501 0.667 . . . . 0.0 111.248 -178.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -88.17 103.24 15.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 175.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.402 ' HB ' ' CD1' ' A' ' 44' ' ' TRP . 21.8 t -127.43 125.32 65.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.826 -174.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 62.42 23.72 14.08 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.787 0.679 . . . . 0.0 111.209 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.61 13.25 76.23 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.31 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.667 ' HD2' ' HD3' ' A' ' 66' ' ' ARG . 71.7 mmtt -117.46 154.62 31.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 m -105.19 106.28 16.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.828 0.347 . . . . 0.0 110.462 179.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.518 ' HB2' HG13 ' A' ' 37' ' ' ILE . 32.8 m95 -105.13 121.46 46.35 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -59.11 -34.5 98.73 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.735 2.29 . . . . 0.0 112.768 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.8 p -146.4 165.38 29.52 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -179.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.85 -28.99 69.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.793 0.33 . . . . 0.0 111.438 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 7.6 mp0 -64.78 -28.55 69.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.632 -178.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.403 ' HB3' ' HE3' ' A' ' 44' ' ' TRP . 36.3 m80 -64.7 -47.06 79.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.471 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -70.87 -35.72 72.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.388 0.613 . . . . 0.0 109.608 177.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -58.51 -41.77 86.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.834 177.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.662 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 68.3 mm-40 -74.37 -46.65 39.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.414 178.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.93 -38.63 76.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.986 -176.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -84.14 -24.5 30.21 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.542 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.661 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.1 ttmp? -60.01 -42.6 94.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.154 0.502 . . . . 0.0 110.242 172.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.433 ' HD1' ' O ' ' A' ' 52' ' ' GLN . 21.8 m-85 -77.37 135.07 38.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.327 178.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.753 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.4 pt? -97.63 12.79 32.39 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.339 0.59 . . . . 0.0 109.484 175.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -98.5 128.52 44.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.91 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -69.94 -35.35 74.46 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -175.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -67.76 -36.92 81.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.849 0.357 . . . . 0.0 110.33 -178.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.406 ' O ' HG13 ' A' ' 65' ' ' ILE . 6.9 m-85 -77.79 -28.18 50.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.944 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 54.6 ttp85 -59.06 -51.8 68.49 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.036 0.446 . . . . 0.0 110.208 175.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -75.57 -19.38 59.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -69.12 -46.31 67.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.211 0.529 . . . . 0.0 110.184 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.608 HG21 ' HB2' ' A' ' 52' ' ' GLN . 68.7 mt -72.95 -19.63 18.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.396 0.617 . . . . 0.0 110.12 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.667 ' HD3' ' HD2' ' A' ' 42' ' ' LYS . 12.6 ttp180 -72.72 -28.17 62.5 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.324 170.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -78.36 -41.97 31.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.253 -176.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.504 HG21 ' HB ' ' A' ' 73' ' ' VAL . 8.4 p -65.28 121.38 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.562 0.696 . . . . 0.0 111.672 -175.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.8 m -77.32 -42.28 37.36 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.422 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.401 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 47.4 t -70.59 127.42 91.98 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.239 -176.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 19.7 Cg_exo -66.61 -30.69 42.25 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.799 2.333 . . . . 0.0 111.924 176.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.2 mmt -70.19 -37.88 75.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.134 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.504 ' HB ' HG21 ' A' ' 68' ' ' VAL . 47.4 t -71.99 -32.22 43.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.091 0.472 . . . . 0.0 110.078 177.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.09 -39.84 93.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.22 173.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.88 -34.72 79.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.05 175.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -61.5 -33.15 73.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.122 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 25.6 mmt -61.77 -50.84 70.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.563 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.14 -26.05 62.74 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.833 -178.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 79' ' ' ARG . 2.6 tpt180 -84.47 -0.22 52.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.932 0.396 . . . . 0.0 110.326 -178.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.02 -31.45 71.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.022 -177.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 75.6 -46.24 0.56 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.95 175.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.5 m -82.59 40.17 0.65 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.306 0.574 . . . . 0.0 111.189 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.407 ' HB3' ' CE2' ' A' ' 56' ' ' PHE . 44.8 mmtm -123.24 151.67 62.65 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.139 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.35 105.17 1.68 Allowed 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.286 1.991 . . . . 0.0 112.909 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.42 HD22 ' HD3' ' A' ' 55' ' ' LYS . 54.2 mt -86.8 145.32 26.66 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 174.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.588 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . 8.0 ptp180 -74.17 164.53 26.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.245 0.545 . . . . 0.0 111.934 -175.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tptt -67.68 -40.75 84.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.708 -172.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.415 ' O ' HG22 ' A' ' 92' ' ' VAL . 10.3 m120 -101.34 23.48 10.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.429 -172.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.402 ' CZ2' ' HE3' ' A' ' 55' ' ' LYS . 38.7 t-105 -58.69 -47.1 85.68 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -175.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -59.35 -29.21 67.5 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -175.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.4 p -90.29 -22.6 21.5 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -176.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 88' ' ' ASN . 31.1 m -108.24 -5.92 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -176.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -49.11 -53.64 19.75 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.095 0.474 . . . . 0.0 111.614 -178.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -71.02 -29.98 66.05 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.52 -178.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -71.35 -42.39 68.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.934 -178.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 79.6 t -60.41 -46.62 94.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.104 0.478 . . . . 0.0 110.218 176.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.439 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 52.6 ttm -64.85 -42.21 95.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.756 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -65.8 -33.5 76.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.731 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.42 -45.12 77.05 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.03 0.443 . . . . 0.0 110.154 175.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.45 98.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.607 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 97' ' ' MET . 95.0 mt -66.04 -32.59 74.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.85 177.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.569 ' HG2' HD11 ' A' ' 152' ' ' LEU . 1.9 tmm_? -64.88 -44.26 90.22 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -69.06 -32.66 72.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.031 0.443 . . . . 0.0 110.669 176.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -63.71 -47.98 78.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.106 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.426 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 56.8 m-85 -85.6 -43.3 13.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -69.36 -43.71 73.02 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.538 -174.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 27.6 mt-30 -80.1 -1.36 39.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.899 0.38 . . . . 0.0 111.44 -175.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -122.95 96.42 5.01 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 170.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -53.74 -38.19 64.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.945 -171.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -57.74 -45.8 85.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 178.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.447 HD21 ' CZ2' ' A' ' 35' ' ' TRP . 34.6 mt -68.72 -42.45 77.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.249 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.604 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 49.4 ttp85 -59.53 -45.21 92.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.551 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.57 -42.49 98.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.709 178.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.595 HD13 ' HA ' ' A' ' 5' ' ' ALA . 50.3 tp -61.71 -48.87 78.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.619 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 153' ' ' ARG . 47.8 tp -56.93 -43.56 81.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.906 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.855 HD23 ' HG2' ' A' ' 153' ' ' ARG . 47.9 mt -68.7 -35.04 76.67 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.168 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.15 -15.1 60.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -176.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 33.7 p -82.06 -21.42 36.88 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 120.199 -0.601 . . . . 0.0 111.913 -176.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.52 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -64.01 148.18 95.5 Favored Pre-proline 0 C--O 1.234 0.247 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.492 174.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -94.5 32.67 10.68 Favored 'Cis proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.906 -1.289 . . . . 0.0 113.544 1.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.31 140.91 48.81 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 176.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -85.79 119.93 26.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.539 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 40.6 mt -80.15 122.78 27.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.499 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 80.4 t -132.48 114.67 23.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.189 0.519 . . . . 0.0 112.123 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -77.99 115.77 17.98 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 167.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.566 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 59.9 t60 -87.8 77.23 8.62 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.739 -173.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.606 ' OG1' ' HA3' ' A' ' 134' ' ' GLY . 1.0 OUTLIER -77.33 96.75 4.69 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.779 -179.588 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -93.86 -16.03 24.47 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.796 -175.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -66.97 -43.92 81.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.493 176.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -163.25 152.96 15.32 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -178.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.19 85.64 5.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.405 0.621 . . . . 0.0 110.044 178.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.508 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 37.5 t80 -149.32 106.21 3.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.566 -176.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.612 ' H ' ' HB3' ' A' ' 142' ' ' LYS . 66.9 m95 65.74 10.06 6.49 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.652 -176.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.606 ' HA3' ' OG1' ' A' ' 127' ' ' THR . . . -131.26 -161.12 10.12 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.57 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.566 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 4.0 p-10 -91.42 -6.58 52.57 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.754 0.311 . . . . 0.0 111.301 -176.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 76.35 7.11 84.83 Favored Glycine 0 N--CA 1.454 -0.155 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.037 177.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.447 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 82.04 40.05 10.87 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.938 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -179.35 -25.91 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.343 0.257 . . . . 0.0 111.6 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . 0.438 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 132.37 -16.31 4.9 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 119.881 -1.152 . . . . 0.0 113.776 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -133.39 82.11 1.97 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 117.315 0.558 . . . . 0.0 110.459 -177.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.39 -60.91 0.19 Allowed Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.246 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.612 ' HB3' ' H ' ' A' ' 133' ' ' TRP . 1.7 ttmp? -175.48 48.87 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -65.76 5.11 0.5 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.003 -0.998 . . . . 0.0 112.735 -171.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.544 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 30.8 ttm180 -54.84 -22.45 14.58 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.405 ' HB2' ' HB3' ' A' ' 133' ' ' TRP . 66.5 tp -61.48 -59.03 5.87 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.715 0.293 . . . . 0.0 110.345 174.458 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.428 ' HA2' HD12 ' A' ' 149' ' ' LEU . . . -61.95 -31.58 79.02 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.567 176.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . 0.441 ' HB3' ' HA ' ' A' ' 144' ' ' ARG . 56.8 t80 -61.68 -43.91 97.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.529 -0.336 . . . . 0.0 110.137 176.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 94.0 mt -66.9 -36.37 82.14 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.76 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.428 HD12 ' HA2' ' A' ' 146' ' ' GLY . 97.5 mt -60.76 -44.65 96.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.554 177.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 73.2 mtm -74.26 -34.59 63.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.875 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.04 -49.63 77.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.486 0.66 . . . . 0.0 109.619 175.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.569 HD11 ' HG2' ' A' ' 102' ' ' ARG . 55.5 tp -65.5 -34.63 78.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.076 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.855 ' HG2' HD23 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -59.12 -40.09 84.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.449 -179.362 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . 0.449 ' O ' HG13 ' A' ' 158' ' ' ILE . 13.7 mm-40 -64.71 -39.04 92.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.501 177.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -64.5 -43.67 93.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.088 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.531 ' HB2' HD21 ' A' ' 116' ' ' LEU . 89.1 mt -69.84 -31.13 68.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.888 0.375 . . . . 0.0 110.496 -177.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.88 -36.29 81.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.353 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 154' ' ' GLU . 97.4 mt -68.3 -42.72 84.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.62 178.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.71 -37.8 85.44 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.023 177.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -64.4 -35.54 81.25 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 7.2 tp -64.53 -29.52 70.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.379 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.78 -179.273 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 51.4 t . . . . . 0 N--CA 1.452 -0.362 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -87.76 81.63 7.56 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.564 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.25 34.86 0.57 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.527 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.882 -177.223 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.1 m -85.98 159.01 3.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.979 0.419 . . . . 0.0 110.317 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.1 mtm -93.14 18.75 8.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.929 -176.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 65.78 115.8 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.311 -178.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.8 t70 52.48 66.54 1.19 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.608 0.718 . . . . 0.0 110.802 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -117.15 150.52 38.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.687 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.506 HG13 ' HD2' ' A' ' 122' ' ' LYS . 3.5 mp -98.73 107.58 20.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 120.973 0.416 . . . . 0.0 110.089 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.2 mt -90.78 111.05 23.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.946 0.403 . . . . 0.0 110.711 -178.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.463 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 0.9 OUTLIER -90.79 104.44 17.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.774 176.744 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -100.76 137.28 39.35 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.774 0.321 . . . . 0.0 110.458 -178.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.431 ' O ' ' HB3' ' A' ' 21' ' ' SER . 5.1 t80 -150.54 169.9 20.42 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.876 175.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.445 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 39.9 t 75.64 109.28 0.07 Allowed 'General case' 0 C--O 1.231 0.099 0 O-C-N 123.924 0.765 . . . . 0.0 111.721 175.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 p -81.17 2.54 27.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.388 176.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -91.57 -4.68 55.1 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.223 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -107.88 165.87 11.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.722 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -77.1 -15.11 59.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.923 -175.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -101.22 -1.55 33.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.916 0.389 . . . . 0.0 111.07 176.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' A' ' 21' ' ' SER . . . -75.74 0.16 62.22 Favored Glycine 0 C--O 1.229 -0.214 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.906 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -57.51 -32.95 67.54 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -63.14 -21.35 66.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.596 -177.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 75.7 m -68.05 144.26 55.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.254 0.549 . . . . 0.0 111.052 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -67.78 -20.2 65.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.86 -176.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -95.06 10.89 34.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.941 0.401 . . . . 0.0 110.9 -177.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.43 140.17 58.09 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.85 0.357 . . . . 0.0 111.286 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.531 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -86.08 59.43 5.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.94 -177.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 50.3 m95 -118.9 116.09 34.55 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.729 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 28.4 Cg_exo -61.59 128.16 23.84 Favored 'Trans proline' 0 C--O 1.238 0.52 0 C-N-CA 123.098 2.532 . . . . 0.0 112.413 -178.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.528 HG22 ' HA ' ' A' ' 104' ' ' LYS . 16.4 pt -112.31 133.7 57.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.891 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -93.95 105.07 17.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.693 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.2 t -123.88 118.94 55.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.996 -175.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 58.62 27.86 16.34 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.631 0.582 . . . . 0.0 111.428 176.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.44 -7.96 66.38 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.131 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -114.67 135.68 53.89 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 122.209 -0.583 . . . . 0.0 110.802 -177.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.5 m -95.4 106.44 18.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.92 -175.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 65.6 m95 -91.38 128.83 45.41 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.795 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.44 -35.55 85.28 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.087 2.524 . . . . 0.0 113.412 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.531 HG22 ' HA ' ' A' ' 34' ' ' ALA . 65.4 p -148.84 165.25 32.06 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 9.3 m -56.83 -41.56 78.09 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.285 0.366 . . . . 0.0 110.703 177.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.787 ' O ' ' HB2' ' A' ' 52' ' ' GLN . 10.0 tp10 -73.65 -1.13 17.68 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.735 -177.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.428 ' NE2' HG13 ' A' ' 68' ' ' VAL . 18.1 m80 -85.03 -40.61 16.65 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 120.984 -1.073 . . . . 0.0 109.47 171.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -74.16 -35.97 64.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.274 0.559 . . . . 0.0 109.573 174.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.558 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 37.8 t80 -72.03 -31.29 66.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.495 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.787 ' HB2' ' O ' ' A' ' 48' ' ' GLU . 3.8 tp-100 -71.73 -45.74 60.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.297 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.92 -37.31 84.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.146 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -88.42 -8.23 55.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.348 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.618 ' HG3' ' CZ2' ' A' ' 89' ' ' TRP . 4.9 ttmp? -69.46 -30.48 68.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.329 0.585 . . . . 0.0 109.936 175.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.49 ' CE2' ' HA2' ' A' ' 78' ' ' GLY . 91.3 m-85 -116.4 175.88 5.36 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.291 -178.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.28 7.23 9.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.792 178.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.781 ' HB2' ' HB2' ' A' ' 61' ' ' TYR . 27.9 m-20 -76.0 126.45 31.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.823 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.452 ' HG3' ' H ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -64.02 -36.52 84.26 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.49 175.942 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 64' ' ' GLU . 35.9 mmtm -65.18 -48.29 73.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.567 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.781 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -63.02 -45.75 90.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.154 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -54.74 -42.79 72.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.66 178.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.546 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 27.5 mt-10 -69.48 -40.64 76.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.355 178.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 6.0 mm-40 -63.77 -44.44 93.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.832 0.348 . . . . 0.0 111.319 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.664 HG21 ' HB3' ' A' ' 52' ' ' GLN . 74.7 mt -67.27 -26.13 35.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.358 0.599 . . . . 0.0 110.675 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 66' ' ' ARG . 0.0 OUTLIER -77.15 -14.99 59.7 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.92 174.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 84.8 mtp180 -96.15 -4.64 42.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.378 -178.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.428 HG13 ' NE2' ' A' ' 49' ' ' HIS . 10.0 p -110.35 132.54 58.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.047 0.451 . . . . 0.0 111.651 -174.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -93.66 -36.83 12.15 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.438 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 2.5 m -63.13 117.17 30.63 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.993 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 21.8 Cg_exo -65.36 -42.06 14.13 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.854 2.369 . . . . 0.0 112.79 -176.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.4 tpt -65.0 -36.15 83.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.098 -175.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 98.4 t -63.97 -44.01 97.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-O 120.928 0.394 . . . . 0.0 110.357 178.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.84 98.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.484 178.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.411 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -61.53 -41.64 97.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.05 178.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.64 -48.3 82.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.282 -179.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.6 ptp -71.61 -22.77 61.67 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.821 -178.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.49 ' HA2' ' CE2' ' A' ' 56' ' ' PHE . . . -77.88 -20.19 73.91 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.634 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.3 mtp85 -86.47 38.73 0.8 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.034 0.445 . . . . 0.0 111.396 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -111.05 109.6 19.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.5 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 81' ' ' ARG . 7.2 tpt180 -90.92 0.79 57.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.499 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.9 m -66.74 -37.84 85.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.035 -176.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.448 ' HD2' ' CE1' ' A' ' 56' ' ' PHE . 9.3 ptpp? -85.26 155.04 60.36 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.796 -178.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.63 117.74 5.26 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.329 2.019 . . . . 0.0 112.123 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.12 174.88 7.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.062 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.66 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 63.1 mtp180 -71.09 143.03 50.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.611 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -47.71 -44.6 27.79 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.174 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -118.01 27.03 9.25 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.474 -175.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.66 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 29.5 t-105 -58.69 -43.4 89.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.97 -15.86 60.22 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.11 -178.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 8.0 m -98.73 -48.89 4.78 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.903 0.382 . . . . 0.0 111.191 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.448 ' O ' HG23 ' A' ' 96' ' ' VAL . 33.4 m -76.69 -8.69 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.478 -176.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.462 ' HG2' ' HZ2' ' A' ' 133' ' ' TRP . 35.9 ttmt -48.63 -53.98 16.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.743 -179.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -69.88 -23.42 63.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.224 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -76.27 -42.92 43.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.962 0.411 . . . . 0.0 110.24 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 92' ' ' VAL . 87.7 t -60.56 -49.84 82.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.029 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 48.6 ttm -69.4 -33.19 72.64 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.991 -178.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 98' ' ' ARG . 14.2 ttm-85 -62.39 -41.65 98.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.769 0.319 . . . . 0.0 110.167 178.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -68.09 -39.31 82.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.617 178.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.64 -46.46 89.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.571 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 96.3 mt -63.9 -39.34 93.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.721 177.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 102' ' ' ARG . 21.5 ttt180 -58.62 -46.99 85.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.04 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.73 -33.16 73.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.884 178.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.528 ' HA ' HG22 ' A' ' 37' ' ' ILE . 61.2 tttp -56.28 -59.35 5.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.268 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.535 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 89.3 m-85 -82.49 -9.69 59.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.167 -176.356 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -87.95 -35.4 17.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.958 0.408 . . . . 0.0 110.721 177.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -77.17 -47.68 19.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.384 -177.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -92.88 108.44 20.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.705 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.16 -29.76 70.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.122 176.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.418 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.4 mp0 -55.94 -48.2 76.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.88 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 47.9 mt -74.51 -36.62 63.21 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.433 -176.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.535 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 25.5 ttm180 -59.53 -45.09 92.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.633 176.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.82 -39.41 94.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.587 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 tp -66.17 -44.36 84.27 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.551 177.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.417 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 53.6 tp -60.39 -51.94 67.35 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.302 179.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.456 HD21 ' HA ' ' A' ' 157' ' ' ALA . 11.0 mp -67.09 -23.09 65.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.595 -177.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -68.43 -22.6 64.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.596 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 44.9 p -71.08 -35.96 72.07 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 116.73 -0.213 . . . . 0.0 111.078 -178.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -49.31 135.86 16.44 Favored Pre-proline 0 N--CA 1.464 0.249 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.47 -179.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.5 Cg_endo -99.55 48.31 1.99 Allowed 'Cis proline' 0 CA--C 1.536 0.604 0 C-N-CA 124.184 -1.173 . . . . 0.0 113.495 0.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -88.5 160.32 17.55 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.811 0.338 . . . . 0.0 111.497 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.506 ' HD2' HG13 ' A' ' 16' ' ' ILE . 46.4 mttp -86.18 146.34 26.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.939 178.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.8 mt -108.53 112.71 25.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.144 177.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 98.6 t -128.97 124.5 61.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.875 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -86.84 117.34 25.51 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.415 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 7.1 t60 -98.24 80.1 2.63 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.427 -170.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.2 t -103.15 162.19 13.17 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 171.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -138.92 15.24 2.67 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.818 0.818 . . . . 0.0 109.81 177.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -81.77 -26.23 34.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.124 173.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -173.95 -174.15 0.9 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.607 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.46 ' HB1' ' HA3' ' A' ' 141' ' ' GLY . . . -135.32 85.6 2.18 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 175.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.497 ' C ' ' H ' ' A' ' 134' ' ' GLY . 13.1 t80 -149.13 116.45 6.11 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.462 ' HZ2' ' HG2' ' A' ' 93' ' ' LYS . 83.3 m95 74.04 -35.69 0.31 Allowed 'General case' 0 N--CA 1.477 0.919 0 O-C-N 123.908 0.755 . . . . 0.0 109.783 -169.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.497 ' H ' ' C ' ' A' ' 132' ' ' TYR . . . -117.63 -172.94 16.12 Favored Glycine 0 N--CA 1.43 -1.706 0 N-CA-C 108.184 -1.966 . . . . 0.0 108.184 177.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.62 ' HB2' ' HB2' ' A' ' 143' ' ' ASN . 0.8 OUTLIER -111.88 168.52 9.52 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 118.935 -1.106 . . . . 0.0 111.615 -175.863 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -79.18 36.24 1.96 Allowed Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.449 ' H ' ' C ' ' A' ' 135' ' ' ASP . . . 88.26 -14.75 58.5 Favored Glycine 0 CA--C 1.523 0.547 0 CA-C-N 114.935 -0.632 . . . . 0.0 114.329 177.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . 0.466 ' CE1' ' HB3' ' A' ' 140' ' ' LYS . 9.9 p80 -111.89 -53.66 2.69 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 118.202 1.001 . . . . 0.0 113.601 -171.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 130.54 53.24 0.1 OUTLIER Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.346 -0.931 . . . . 0.0 112.479 -175.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.466 ' HB3' ' CE1' ' A' ' 138' ' ' HIS . 60.8 tttp -172.92 37.43 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.208 0.528 . . . . 0.0 110.155 -178.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.46 ' HA3' ' HB1' ' A' ' 131' ' ' ALA . . . -123.42 -65.28 0.21 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 120.095 -1.05 . . . . 0.0 113.217 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.494 ' C ' ' H ' ' A' ' 144' ' ' ARG . 48.4 tttp -173.2 25.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 117.255 0.527 . . . . 0.0 112.211 175.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.62 ' HB2' ' HB2' ' A' ' 135' ' ' ASP . 9.9 t30 -51.54 5.65 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.19 1.396 . . . . 0.0 114.166 173.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.494 ' H ' ' C ' ' A' ' 142' ' ' LYS . 9.9 tpt180 -45.57 -21.02 0.08 Allowed 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 22.9 tp -57.58 -45.76 84.83 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.891 0.377 . . . . 0.0 110.496 174.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -62.64 -31.46 80.04 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.701 -0.559 . . . . 0.0 111.701 178.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -66.8 -39.76 87.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 175.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 70.1 mt -63.61 -42.56 98.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.953 176.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 98.8 mt -60.71 -45.52 93.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.831 178.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.553 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 71.5 mtm -67.25 -39.05 86.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.96 178.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -61.86 -45.38 94.01 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.126 0.489 . . . . 0.0 110.306 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 67.6 tp -64.58 -39.11 93.15 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.658 177.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.417 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 59.8 ttp180 -56.59 -49.8 73.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.314 177.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 150' ' ' MET . 14.1 mm-40 -62.13 -36.27 81.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.603 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -62.23 -56.13 21.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.313 176.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.491 HD22 ' NH2' ' A' ' 112' ' ' ARG . 37.3 mt -68.89 -25.14 64.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.098 -173.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -62.68 -52.39 63.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.107 173.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 73.0 mt -73.0 -38.26 55.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.794 -179.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -57.33 -47.39 81.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.477 177.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -79.61 -14.4 58.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.101 179.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 18.5 tp -76.76 -20.52 56.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.169 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 . . . . . 0 CA--C 1.53 0.174 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.869 177.996 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.9 p . . . . . 0 CA--C 1.528 0.121 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.565 ' HB3' HE22 ' A' ' 6' ' ' GLN . 39.9 mtm105 62.41 83.53 0.15 Allowed 'General case' 0 C--N 1.342 0.254 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.141 -176.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.27 76.46 8.39 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.37 -176.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.565 HE22 ' HB3' ' A' ' 4' ' ' ARG . 2.3 mp0 . . . . . 0 C--N 1.323 -0.546 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.752 175.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 . . . . . 0 N--CA 1.464 0.243 0 CA-C-O 121.447 0.642 . . . . 0.0 111.72 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 m -84.75 16.18 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.991 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 43.3 mtm 66.77 -100.43 0.06 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.746 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 179.37 148.21 0.24 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 62.51 10.38 3.99 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 123.421 0.45 . . . . 0.0 111.603 177.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.1 m -83.35 114.36 21.37 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.302 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 51.6 mt -96.68 114.08 32.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.777 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.7 mt -93.21 109.97 22.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.433 -175.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.481 HD22 ' N ' ' A' ' 18' ' ' ASN . 0.9 OUTLIER -96.41 103.56 15.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.763 177.138 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -109.15 127.11 53.92 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.234 -176.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -150.55 100.59 2.87 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.66 170.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 m 161.89 101.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.209 1.404 . . . . 0.0 108.291 -177.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.53 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 10.2 p -79.46 -55.4 5.08 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.646 0.26 . . . . 0.0 111.376 -176.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m 56.65 -95.35 0.05 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.676 -176.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -178.2 21.03 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.094 0.473 . . . . 0.0 110.576 178.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.9 p30 -136.97 -90.95 0.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -86.41 -4.95 59.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.57 0.7 . . . . 0.0 110.182 -173.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.53 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -73.31 -0.02 50.65 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.223 -0.898 . . . . 0.0 112.945 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.464 ' HA ' ' CB ' ' A' ' 33' ' ' ALA . 34.5 t70 -54.54 -23.57 17.16 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -176.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -64.88 -29.11 70.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.599 178.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.1 t -77.6 143.47 38.26 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -62.04 -30.91 71.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.934 0.397 . . . . 0.0 110.824 -174.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.515 ' HB3' HG21 ' A' ' 22' ' ' THR . 16.7 t80 -75.47 11.53 1.24 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.416 -173.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.464 ' CB ' ' HA ' ' A' ' 28' ' ' ASP . . . -73.83 106.0 5.36 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 175.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.525 ' HA ' ' HB ' ' A' ' 46' ' ' THR . . . -74.32 59.93 0.81 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.624 0.726 . . . . 0.0 112.522 -171.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 62.0 m95 -93.67 125.54 53.17 Favored Pre-proline 0 C--N 1.312 -1.06 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.742 172.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.55 125.37 17.17 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 122.678 2.252 . . . . 0.0 112.042 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.666 HG22 ' HA ' ' A' ' 104' ' ' LYS . 15.3 pt -114.99 141.87 30.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.872 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -100.05 100.1 10.93 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.426 HG12 ' OD2' ' A' ' 40' ' ' ASP . 4.5 t -124.04 127.08 73.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.11 -174.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD2' HG12 ' A' ' 39' ' ' VAL . 24.6 m-20 63.5 6.7 2.64 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.965 0.791 . . . . 0.0 111.913 176.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 114.02 -3.13 24.14 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.556 -0.83 . . . . 0.0 113.088 177.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -123.15 155.28 37.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.247 0.523 . . . . 0.0 111.065 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.6 m -94.73 119.98 34.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.448 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.487 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 37.9 m95 -109.13 124.21 34.69 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.445 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.612 ' O ' ' HB ' ' A' ' 46' ' ' THR . 4.8 Cg_exo -76.05 48.05 2.16 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.32 2.68 . . . . 0.0 113.683 -175.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.612 ' HB ' ' O ' ' A' ' 45' ' ' PRO . 1.6 t 129.57 160.69 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.5 1.52 . . . . 0.0 109.701 172.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 m -58.77 -38.78 79.25 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 123.563 0.539 . . . . 0.0 111.294 -177.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.438 ' H ' HG23 ' A' ' 46' ' ' THR . 14.1 mp0 -53.11 -43.1 66.61 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.305 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 32.2 m80 -64.53 -39.52 93.92 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.328 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -76.1 -46.5 28.61 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.582 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -60.03 -50.03 75.34 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.578 -178.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.771 HE21 ' HA3' ' A' ' 78' ' ' GLY . 42.0 tp60 -64.63 -39.89 94.5 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.662 -177.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.918 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -68.71 -35.45 77.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.598 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -79.62 -16.84 55.1 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.909 0.385 . . . . 0.0 110.333 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.451 ' HE3' ' CD1' ' A' ' 89' ' ' TRP . 79.8 tttt -67.41 -21.8 65.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.793 -178.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.426 ' HZ ' ' CA ' ' A' ' 78' ' ' GLY . 82.2 m-85 -102.21 178.47 4.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.079 0.466 . . . . 0.0 111.901 -175.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.421 ' N ' HD12 ' A' ' 57' ' ' LEU . 5.6 mp -111.17 -37.01 5.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.642 -175.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.533 ' OD2' ' HB2' ' A' ' 61' ' ' TYR . 1.8 p-10 -75.5 111.65 11.02 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.602 0.715 . . . . 0.0 110.582 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -62.06 -32.85 73.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.658 -1.156 . . . . 0.0 111.791 -174.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.42 -37.9 76.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.105 0.479 . . . . 0.0 109.915 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.533 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . 2.0 t80 -77.06 -33.85 57.16 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.073 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.918 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 32.2 ttp85 -57.73 -44.84 86.3 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.372 0.606 . . . . 0.0 109.803 174.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -68.44 -31.57 70.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.233 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -70.14 -33.22 71.53 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.358 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 53' ' ' ALA . 75.2 mt -72.65 -23.19 20.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.005 0.431 . . . . 0.0 110.772 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.455 ' HB2' ' CZ3' ' A' ' 44' ' ' TRP . 55.3 ttp85 -84.33 -20.67 31.66 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.286 0.565 . . . . 0.0 109.637 171.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -75.99 -30.55 58.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.143 -177.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.9 p -78.47 129.31 37.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.92 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 43.9 t -77.19 -37.58 53.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.583 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.457 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.9 m -77.18 119.55 77.95 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 -177.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 22.1 Cg_exo -65.2 -37.59 31.24 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.844 2.363 . . . . 0.0 112.401 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.4 tpt -65.35 -41.15 94.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.819 -176.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 94.5 t -60.22 -38.05 75.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.129 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.437 ' HB1' HG23 ' A' ' 65' ' ' ILE . . . -60.81 -58.51 8.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.015 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 79' ' ' ARG . . . -60.98 -37.84 83.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.937 178.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.84 -49.92 73.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.73 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -78.42 -19.28 53.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.867 0.365 . . . . 0.0 110.967 -176.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.771 ' HA3' HE21 ' A' ' 52' ' ' GLN . . . -93.85 0.03 66.82 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.41 176.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.459 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 33.1 ttt180 -89.95 -9.93 46.98 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -79.03 164.38 24.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.573 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.451 HH11 ' HD3' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -94.21 -5.99 45.71 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.275 -174.104 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.7 m -72.33 -8.04 52.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.171 0.51 . . . . 0.0 111.299 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -111.71 123.44 34.74 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.033 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.8 119.9 6.86 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.422 2.081 . . . . 0.0 111.185 173.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 59.2 mt -88.87 156.5 18.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.05 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.651 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 67.1 mtt180 -61.85 125.96 25.68 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 176.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -54.11 -44.13 71.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.933 -174.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -102.07 27.29 6.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.378 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.651 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 73.7 t-105 -58.15 -44.12 87.7 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.235 179.037 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -61.36 -21.95 64.5 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.591 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.9 m -80.55 -38.05 30.31 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.783 0.325 . . . . 0.0 110.874 177.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.4 m -97.32 1.91 10.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.087 0.47 . . . . 0.0 111.228 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -55.64 29.49 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.964 -178.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.82 -28.9 70.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.362 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -70.01 -51.35 32.99 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.795 0.331 . . . . 0.0 110.522 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 87.3 t -62.72 -39.3 84.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.4 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.463 ' HA ' ' CE ' ' A' ' 97' ' ' MET . 3.3 tpt -63.4 -43.21 98.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.203 178.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.629 ' HA ' HD11 ' A' ' 148' ' ' LEU . 56.7 ttp180 -61.8 -40.48 95.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.772 179.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -65.33 -50.53 65.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.765 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.82 -45.87 87.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.406 -177.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.488 HD12 HD12 ' A' ' 148' ' ' LEU . 35.0 mt -65.17 -37.66 88.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.994 -176.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.649 ' HG3' HD21 ' A' ' 156' ' ' LEU . 31.2 ttp85 -67.67 -36.58 80.98 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.365 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.582 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -66.2 -31.77 72.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.117 0.484 . . . . 0.0 109.989 177.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.666 ' HA ' HG22 ' A' ' 37' ' ' ILE . 59.7 tttm -62.77 -49.35 75.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.886 179.115 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 81.8 m-85 -82.32 -33.32 29.0 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -176.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -75.26 -19.25 59.82 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 121.944 -0.472 . . . . 0.0 111.567 -179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.582 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.0 OUTLIER -86.38 -46.39 10.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.77 0.319 . . . . 0.0 110.242 177.329 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -99.39 100.22 11.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.423 ' HB1' HH21 ' A' ' 112' ' ' ARG . . . -62.29 -31.83 72.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.399 -173.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.489 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.6 pm0 -68.87 -33.87 74.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.666 0.27 . . . . 0.0 110.661 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 57.9 mt -73.19 -35.99 66.48 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 176.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.487 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 28.0 ttp85 -58.17 -48.67 79.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.478 175.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.58 -40.03 93.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.593 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.6 tp -61.5 -43.45 98.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.633 178.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 39.5 tp -62.04 -56.42 19.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.629 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.3 mp -66.88 -16.55 64.38 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.991 -0.284 . . . . 0.0 111.5 -176.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -75.96 -13.2 60.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 60.7 p -89.23 -16.44 31.24 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 120.39 -0.524 . . . . 0.0 111.441 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.507 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -55.7 139.41 68.92 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.722 176.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -101.26 39.14 4.8 Favored 'Cis proline' 0 CA--C 1.535 0.548 0 C-N-CA 124.295 -1.127 . . . . 0.0 113.492 -1.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.04 153.56 42.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 0.0 111.151 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.525 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 56.3 tttp -86.98 122.98 31.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.035 -178.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 42.9 mt -91.2 125.13 35.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.527 -177.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 87.9 t -138.54 138.09 42.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.241 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -107.26 141.98 37.74 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -105.25 77.58 1.31 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.52 0.676 . . . . 0.0 109.612 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.69 86.36 5.3 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.731 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -78.02 -23.72 48.12 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.001 -174.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -83.69 -22.36 32.08 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -175.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -154.69 148.34 25.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.866 0.365 . . . . 0.0 110.824 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.581 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -106.56 87.43 2.53 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.621 -177.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.524 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 3.7 t80 -147.55 -37.75 0.2 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.852 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.571 ' HB3' HD22 ' A' ' 145' ' ' LEU . 7.1 m95 -134.45 32.55 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -176.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -162.21 -128.35 0.94 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 119.66 -1.257 . . . . 0.0 112.374 -177.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.31 -7.98 16.52 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.335 0.588 . . . . 0.0 109.688 174.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 70.69 6.06 58.16 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.539 178.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 83.58 11.4 80.0 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.303 -0.475 . . . . 0.0 112.467 -176.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -164.06 28.22 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.689 0.244 . . . . 0.0 111.14 -177.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 81.18 -51.31 4.34 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.558 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -80.7 58.32 3.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.174 0.511 . . . . 0.0 110.823 -175.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.581 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -123.3 15.26 8.18 Favored Glycine 0 C--N 1.318 -0.461 0 CA-C-N 115.754 -0.657 . . . . 0.0 113.85 -178.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.524 ' HD2' ' HA ' ' A' ' 132' ' ' TYR . 50.3 mttm 69.12 78.47 0.21 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.253 0.549 . . . . 0.0 111.375 178.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -70.06 5.31 1.67 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.335 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -18.62 37.76 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -177.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.571 HD22 ' HB3' ' A' ' 133' ' ' TRP . 43.1 tp -65.79 -53.0 46.12 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 118.239 0.472 . . . . 0.0 109.993 175.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -58.92 -39.56 94.22 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 177.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -64.69 -44.87 88.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.714 -0.243 . . . . 0.0 110.659 177.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 98' ' ' ARG . 1.7 tm? -60.44 -45.94 91.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 90.5 mt -56.37 -43.46 79.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.157 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.525 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 73.8 mtm -72.46 -43.47 63.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.13 -179.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -66.73 -39.5 87.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.988 0.423 . . . . 0.0 110.457 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.502 HD11 ' HB2' ' A' ' 102' ' ' ARG . 55.0 tp -66.47 -37.65 85.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.849 176.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.641 ' HG2' HH11 ' A' ' 153' ' ' ARG . 23.3 ttp85 -61.23 -36.11 79.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.397 176.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 150' ' ' MET . 49.7 mm-40 -58.64 -49.18 78.45 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.035 0.445 . . . . 0.0 110.229 174.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -62.68 -46.01 90.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.831 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.649 HD21 ' HG3' ' A' ' 102' ' ' ARG . 97.8 mt -64.22 -32.96 74.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.752 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.35 -61.32 1.84 Allowed 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.09 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 69.6 mt -58.0 -38.47 67.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -170.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -64.23 -33.36 75.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.024 0.44 . . . . 0.0 111.228 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -94.03 -20.16 20.2 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.574 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 26.0 tp -72.63 -32.95 66.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.68 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 . . . . . 0 C--O 1.234 0.266 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.554 173.291 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.684 HG23 ' HB2' ' A' ' 25' ' ' ASP . 3.4 p . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 55.1 mtt85 -119.87 -36.85 3.2 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.114 -0.235 . . . . 0.0 111.235 -172.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.507 ' HB1' HD13 ' A' ' 114' ' ' LEU . . . 65.63 14.49 9.54 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.811 0.694 . . . . 0.0 110.472 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 . . . . . 0 C--N 1.331 -0.22 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.833 -175.117 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.3 t60 . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.4 m -87.52 -175.14 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.113 -177.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.427 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 10.1 mtt -97.7 -85.41 0.36 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.587 -174.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.427 ' H ' ' HB2' ' A' ' 12' ' ' MET . 3.2 pt20 -177.97 114.68 0.08 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.873 179.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.9 t70 57.9 31.53 20.7 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.812 0.815 . . . . 0.0 110.289 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.5 m -76.33 146.4 38.85 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.766 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.2 mt -109.01 108.69 25.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.222 0.534 . . . . 0.0 110.516 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.4 mt -89.91 101.81 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.158 -175.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -97.45 101.15 12.62 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.123 172.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -101.19 154.06 19.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.823 -176.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -150.17 164.32 35.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.1 p 54.09 100.61 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.632 0.773 . . . . 0.0 111.843 -177.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -69.02 2.99 2.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.62 -175.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.0 p -56.41 -36.72 69.25 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -176.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -92.69 165.52 12.92 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.287 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.684 ' HB2' HG23 ' A' ' 3' ' ' VAL . 6.0 p-10 -82.57 2.17 34.45 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -171.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -101.16 -4.4 27.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.187 0.518 . . . . 0.0 109.851 174.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -93.34 -0.23 67.77 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.682 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.462 ' CG ' HD22 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -58.0 -21.67 45.97 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -173.044 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.467 ' CZ ' ' HG ' ' A' ' 114' ' ' LEU . 97.1 m-85 -55.33 -21.73 16.25 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -177.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.531 ' HA ' ' OE2' ' A' ' 125' ' ' GLU . 22.8 t -62.42 141.68 58.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.097 0.475 . . . . 0.0 110.477 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -73.34 -21.38 60.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.751 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -90.81 6.08 45.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.176 0.512 . . . . 0.0 110.29 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.474 ' HB1' ' HD1' ' A' ' 35' ' ' TRP . . . -64.15 137.22 57.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.02 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.459 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -84.7 59.69 5.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.294 0.568 . . . . 0.0 111.136 -176.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.564 ' HB2' ' HE2' ' A' ' 104' ' ' LYS . 81.4 m95 -112.18 113.36 51.75 Favored Pre-proline 0 C--N 1.318 -0.796 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.882 176.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.58 125.65 19.73 Favored 'Trans proline' 0 C--O 1.237 0.475 0 C-N-CA 123.289 2.659 . . . . 0.0 112.785 -176.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.669 HG22 ' HA ' ' A' ' 104' ' ' LYS . 26.9 pt -115.95 146.44 20.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.681 179.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -109.72 103.32 12.13 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.4 t -122.77 124.06 69.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.705 -175.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 59.62 24.93 13.77 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 123.805 0.691 . . . . 0.0 111.085 178.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.27 -4.02 82.46 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.881 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -104.44 138.56 40.65 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 122.363 -0.492 . . . . 0.0 110.805 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.9 m -90.74 114.31 26.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.454 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.45 ' HB2' HG13 ' A' ' 37' ' ' ILE . 51.3 m95 -108.58 130.62 22.53 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.82 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 21.0 Cg_exo -65.95 -28.83 49.82 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.614 2.209 . . . . 0.0 112.467 -178.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.459 HG22 ' HA ' ' A' ' 34' ' ' ALA . 19.6 p -147.7 162.71 38.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.983 -177.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.1 m -66.85 -30.25 70.37 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.037 0.446 . . . . 0.0 110.616 178.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.402 ' OE1' ' HB3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -64.11 -28.99 70.15 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.611 -177.048 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.599 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 28.2 m80 -66.87 -41.81 86.68 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.971 -0.292 . . . . 0.0 110.845 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -70.9 -37.97 73.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.394 0.616 . . . . 0.0 109.511 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.524 ' HA ' HG11 ' A' ' 96' ' ' VAL . 78.3 t80 -61.35 -40.14 93.17 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.489 176.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.531 ' NE2' ' HA ' ' A' ' 75' ' ' ALA . 4.3 tp60 -72.28 -45.32 60.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.652 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.947 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -65.69 -38.91 90.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.168 -177.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.37 -16.94 44.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.582 0.215 . . . . 0.0 111.582 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.863 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.8 ttmp? -57.2 -38.39 73.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.156 0.503 . . . . 0.0 110.526 173.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -98.93 149.08 23.32 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.337 -178.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.803 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.3 pt? -95.71 1.95 53.71 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.244 0.545 . . . . 0.0 110.065 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -87.79 111.08 20.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.137 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.43 ' OE2' ' HD2' ' A' ' 62' ' ' ARG . 6.9 tp10 -60.43 -33.47 72.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.958 -177.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -62.71 -51.83 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.879 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.45 ' O ' ' HB3' ' A' ' 64' ' ' GLU . 0.5 OUTLIER -66.93 -29.8 69.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.018 0.437 . . . . 0.0 110.418 179.724 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.947 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.4 ttm180 -65.28 -41.32 94.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.122 175.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -62.96 -35.89 81.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.717 175.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 61' ' ' TYR . 11.4 tp10 -60.9 -55.43 33.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.905 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.55 ' O ' HG12 ' A' ' 68' ' ' VAL . 1.8 mp -61.98 -25.95 38.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 120.901 0.382 . . . . 0.0 111.309 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -71.87 -35.78 69.89 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 121.784 -0.572 . . . . 0.0 111.353 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -86.37 -0.03 55.04 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.702 -173.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.55 HG12 ' O ' ' A' ' 65' ' ' ILE . 11.9 p -95.59 117.54 39.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.32 0.581 . . . . 0.0 110.02 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.8 m -81.95 -24.97 35.25 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.991 0.424 . . . . 0.0 110.455 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.4 m -77.22 116.45 57.63 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.307 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.599 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 31.5 Cg_exo -59.85 -55.02 1.88 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.192 2.595 . . . . 0.0 113.064 -175.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 18.2 ttt -65.58 -22.84 66.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.498 -172.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 95.7 t -72.59 -37.79 57.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.838 0.351 . . . . 0.0 110.259 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.68 -45.81 92.74 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.051 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.531 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -62.2 -42.58 99.42 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.532 176.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -60.06 -55.91 28.08 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.579 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -74.78 -19.29 60.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.836 0.351 . . . . 0.0 111.121 -177.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -93.82 0.18 67.04 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.81 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 46.5 ttt180 -79.47 -0.61 33.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.196 0.522 . . . . 0.0 109.831 175.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -75.96 127.79 33.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.912 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.7 ttt180 -98.29 7.8 45.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.693 -175.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.2 m -83.01 -15.45 51.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.23 0.538 . . . . 0.0 110.344 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -79.32 150.24 73.63 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.147 179.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.429 ' HB2' HD21 ' A' ' 57' ' ' LEU . 18.3 Cg_endo -58.23 110.41 0.64 Allowed 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.657 2.238 . . . . 0.0 112.333 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.2 mt -85.99 120.77 27.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.829 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -68.63 134.0 49.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.257 0.551 . . . . 0.0 110.292 -178.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.51 -28.46 64.97 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.447 -170.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -90.88 16.88 8.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.561 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.484 ' CZ3' ' HA ' ' A' ' 55' ' ' LYS . 53.7 t-105 -58.98 -33.37 70.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.301 0.572 . . . . 0.0 109.871 174.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -56.63 -42.13 78.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.255 175.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 m -81.01 -43.34 19.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.69 -175.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.438 HG22 ' HA ' ' A' ' 89' ' ' TRP . 29.6 m -87.45 -3.46 9.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -170.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.48 ' HG3' ' N ' ' A' ' 94' ' ' GLU . 6.3 ptpp? -57.36 -36.88 71.78 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.839 0.352 . . . . 0.0 110.764 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.48 ' N ' ' HG3' ' A' ' 93' ' ' LYS . 7.6 pt-20 -78.41 -33.53 48.65 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.135 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -63.1 -43.77 97.57 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 -178.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.524 HG11 ' HA ' ' A' ' 51' ' ' PHE . 54.4 t -64.16 -49.17 82.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.382 176.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 10.1 mmt -61.45 -54.13 47.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.865 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -64.34 -27.09 68.79 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.789 -0.187 . . . . 0.0 111.314 -175.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -77.41 -46.38 22.85 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 176.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.64 -42.06 98.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.738 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 91.5 mt -64.88 -37.42 87.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.705 178.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.503 ' HA ' HD21 ' A' ' 152' ' ' LEU . 21.5 ttm-85 -63.46 -45.03 92.7 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 177.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.527 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -63.49 -38.37 90.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.781 0.324 . . . . 0.0 110.311 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.669 ' HA ' HG22 ' A' ' 37' ' ' ILE . 15.0 tptp -54.11 -56.3 19.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.499 176.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -80.64 -46.48 15.56 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -175.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.508 ' OE2' HD22 ' A' ' 156' ' ' LEU . 18.2 mm-40 -65.61 -21.56 66.59 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -175.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.8 tp-100 -79.29 -44.48 21.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.096 0.474 . . . . 0.0 110.506 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 64.5 m-70 -99.54 112.23 24.47 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.924 -176.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -59.39 -32.16 69.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.844 0.354 . . . . 0.0 110.352 178.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.412 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.3 mp0 -58.01 -60.1 4.24 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.034 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.462 HD22 ' CG ' ' A' ' 28' ' ' ASP . 13.0 mt -69.44 -34.47 74.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.497 -175.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 108' ' ' HIS . 18.8 ttt180 -54.86 -54.67 39.41 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.137 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.13 -36.73 80.16 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.565 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.507 HD13 ' HB1' ' A' ' 5' ' ' ALA . 42.9 tp -58.09 -48.5 79.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.803 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.441 HD23 HD12 ' A' ' 156' ' ' LEU . 49.2 tp -58.61 -48.78 79.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.26 178.239 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.527 HD21 ' HB2' ' A' ' 156' ' ' LEU . 33.5 mt -70.16 -18.4 63.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.764 0.316 . . . . 0.0 111.339 -175.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -80.74 -14.82 57.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.682 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 72.9 p -73.74 -31.62 63.45 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.297 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.49 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -57.71 136.37 82.82 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.993 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.49 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 72.4 Cg_endo -100.44 72.13 0.16 OUTLIER 'Cis proline' 0 N--CA 1.455 -0.768 0 C-N-CA 124.267 -1.139 . . . . 0.0 113.529 -0.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -110.98 157.59 19.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.842 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.439 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 0.3 OUTLIER -83.58 140.96 31.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.172 176.04 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.479 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 67.7 mt -109.02 114.83 28.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.304 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 42.3 t -129.09 115.9 38.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.153 -177.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.531 ' OE2' ' HA ' ' A' ' 30' ' ' SER . 40.2 tt0 -80.73 133.63 35.7 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 172.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 45.1 t60 -121.75 119.47 31.8 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.194 -175.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 13.0 t -121.9 166.45 14.39 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 170.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.49 ' HA ' ' HA3' ' A' ' 137' ' ' GLY . 3.9 mp0 -116.34 4.93 13.48 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.946 173.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -124.63 110.97 15.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.524 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 25.7 t70 74.47 112.75 0.07 Allowed 'General case' 0 N--CA 1.465 0.291 0 O-C-N 124.563 1.164 . . . . 0.0 111.867 176.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.664 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -86.39 112.79 21.79 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.964 178.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -155.21 -68.49 0.12 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.452 -176.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.568 ' HB3' HD22 ' A' ' 145' ' ' LEU . 92.1 m95 -110.34 58.18 0.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.414 0.626 . . . . 0.0 109.504 177.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 131.31 156.73 8.57 Favored Glycine 0 N--CA 1.442 -0.95 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 -171.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.987 ' HA ' ' HA3' ' A' ' 141' ' ' GLY . 14.2 t0 -54.75 137.34 44.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.769 0.284 . . . . 0.0 111.715 -174.032 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -88.01 31.18 4.79 Favored Glycine 0 C--N 1.333 0.367 0 O-C-N 123.58 0.55 . . . . 0.0 111.988 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.49 ' HA3' ' HA ' ' A' ' 128' ' ' GLU . . . 78.98 54.48 4.12 Favored Glycine 0 C--N 1.317 -0.486 0 CA-C-N 114.838 -0.681 . . . . 0.0 114.076 177.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . 0.495 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 4.7 p80 -174.79 -37.11 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 135.09 25.36 0.54 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 120.194 -1.003 . . . . 0.0 112.654 -175.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.495 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 96.9 mttt -156.68 91.01 1.19 Allowed 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.987 ' HA3' ' HA ' ' A' ' 135' ' ' ASP . . . -142.16 1.18 1.65 Allowed Glycine 0 C--N 1.312 -0.776 0 C-N-CA 119.614 -1.279 . . . . 0.0 114.604 -178.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.419 ' C ' ' H ' ' A' ' 144' ' ' ARG . 24.5 mtmm 65.29 88.96 0.1 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.634 0.73 . . . . 0.0 110.37 -176.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -67.56 5.21 0.84 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.378 178.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.604 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 5.9 mmt180 -54.09 -24.74 18.62 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.568 HD22 ' HB3' ' A' ' 133' ' ' TRP . 52.1 tp -65.89 -52.96 45.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.106 0.479 . . . . 0.0 109.893 175.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 123' ' ' LEU . . . -66.21 -28.3 73.59 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.658 176.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -64.71 -37.74 88.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 91.9 mt -69.8 -35.91 75.23 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.374 175.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.473 HD12 ' HA2' ' A' ' 146' ' ' GLY . 95.7 mt -61.59 -44.68 96.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.185 176.188 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.551 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 74.3 mtm -72.74 -30.95 64.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.782 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -62.32 -54.2 44.04 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.503 HD21 ' HA ' ' A' ' 102' ' ' ARG . 56.6 tp -61.25 -39.3 89.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.847 178.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -53.0 -55.32 24.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.045 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . 0.551 ' HG2' ' O ' ' A' ' 150' ' ' MET . 11.4 mm-40 -62.36 -39.19 92.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.222 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.804 HE21 ' HA ' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -61.18 -45.66 93.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.507 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.684 ' O ' ' HG2' ' A' ' 160' ' ' LYS . 87.2 mt -64.55 -44.78 89.68 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.458 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.18 -51.47 68.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.165 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 154' ' ' GLU . 82.1 mt -55.78 -40.98 64.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 O-C-N 123.072 0.232 . . . . 0.0 110.632 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.2 -47.9 84.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.686 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . 0.684 ' HG2' ' O ' ' A' ' 156' ' ' LEU . 46.6 mmtm -67.13 -35.23 79.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.739 -177.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.48 -23.23 65.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.513 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 . . . . . 0 C--N 1.324 -0.508 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -175.918 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 121.095 0.474 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 72.9 mtm180 -115.66 11.36 15.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.556 -176.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.22 -25.29 65.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.45 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.582 -177.668 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 p-80 . . . . . 0 CA--C 1.52 -0.183 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 31.7 m -104.36 176.66 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 120.661 0.267 . . . . 0.0 110.675 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.43 ' N ' ' SD ' ' A' ' 12' ' ' MET . 0.2 OUTLIER -99.93 -96.68 0.25 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.801 -174.164 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -146.65 116.27 7.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.286 -177.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 48.11 36.84 7.03 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 123.708 0.63 . . . . 0.0 111.917 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.2 m -76.32 125.08 28.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.805 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.689 HG13 ' HD3' ' A' ' 122' ' ' LYS . 2.2 mp -85.49 116.77 29.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 174.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.0 mt -96.71 98.43 7.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.956 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.515 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 45.4 m-80 -86.74 101.48 13.34 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 177.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.499 ' O ' ' HA ' ' A' ' 125' ' ' GLU . 49.7 p90 -103.8 146.48 28.56 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 177.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -150.34 141.58 23.2 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.503 -177.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 96.0 p 60.18 119.72 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.656 1.222 . . . . 0.0 112.358 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.777 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 0.6 OUTLIER -55.44 -64.66 0.77 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.931 178.61 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.3 m 45.87 -95.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.848 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -160.74 34.47 0.15 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 122.059 0.933 . . . . 0.0 108.556 -177.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -126.35 -145.29 0.32 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.167 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.18 -1.42 15.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.424 178.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.777 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -60.64 -0.15 1.24 Allowed Glycine 0 CA--C 1.525 0.697 0 CA-C-N 115.787 -0.642 . . . . 0.0 114.524 -178.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -55.12 -25.48 31.98 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.011 0.905 . . . . 0.0 111.073 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -65.51 -36.95 85.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.763 174.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.0 m -57.32 145.69 31.38 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.511 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -81.22 10.85 4.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.868 -175.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -105.48 6.27 32.25 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.49 0.662 . . . . 0.0 109.481 175.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.519 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -71.43 141.92 50.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.635 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.62 52.53 1.91 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.101 0.477 . . . . 0.0 111.616 -176.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -108.26 106.65 59.04 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.957 177.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -56.48 139.57 87.54 Favored 'Trans proline' 0 C--O 1.238 0.522 0 C-N-CA 123.064 2.509 . . . . 0.0 112.547 -178.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.509 HG13 ' HB2' ' A' ' 44' ' ' TRP . 24.7 pt -119.98 131.66 71.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.746 -178.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -96.62 93.56 6.82 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 44.5 t -102.66 123.61 56.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.85 -176.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 58.99 24.29 12.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.329 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 97.09 3.88 58.82 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.711 176.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.465 ' HD3' ' HA ' ' A' ' 42' ' ' LYS . 25.0 mmtp -128.01 152.12 48.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.133 0.966 . . . . 0.0 111.822 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.0 m -91.63 113.83 26.2 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.557 -171.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.509 ' HB2' HG13 ' A' ' 37' ' ' ILE . 63.4 m95 -101.29 128.53 29.06 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 172.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.55 -39.02 90.25 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.933 2.422 . . . . 0.0 112.521 -176.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.82 171.28 17.97 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.066 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.8 m -69.86 -43.33 72.11 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -172.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.628 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -62.5 -31.7 72.5 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -175.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.489 ' HE2' HG13 ' A' ' 68' ' ' VAL . 19.7 m80 -55.06 -41.85 71.99 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.459 ' CE2' HG13 ' A' ' 96' ' ' VAL . 55.2 t80 -73.07 -40.63 64.89 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.276 178.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.481 ' HA ' HG11 ' A' ' 96' ' ' VAL . 54.2 t80 -61.92 -51.74 66.91 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.977 -179.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.628 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 11.3 mm100 -62.35 -40.09 95.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.946 -177.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.484 ' HB1' ' HB2' ' A' ' 62' ' ' ARG . . . -66.95 -27.6 67.6 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.155 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -84.38 -19.83 32.94 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.542 -177.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -64.28 -52.62 57.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.981 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.556 ' HE1' ' HG3' ' A' ' 83' ' ' LYS . 84.9 m-85 -69.85 153.1 43.76 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -169.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.447 ' N ' HD12 ' A' ' 57' ' ' LEU . 6.0 mp -97.94 -1.45 42.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.883 173.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.666 ' HB2' ' HB2' ' A' ' 61' ' ' TYR . 5.8 m-20 -86.8 110.78 20.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.524 176.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -60.56 -36.46 78.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.116 0.484 . . . . 0.0 109.882 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -62.36 -41.38 98.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.7 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.666 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 1.8 m-85 -64.81 -44.8 88.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.319 -0.4 . . . . 0.0 112.006 -175.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.484 ' HB2' ' HB1' ' A' ' 53' ' ' ALA . 5.1 ptp85 -66.75 -31.16 71.63 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.951 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -70.15 -35.88 74.36 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 174.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -64.7 -40.73 95.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.866 176.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.56 ' HA ' HG12 ' A' ' 68' ' ' VAL . 72.5 mt -71.88 -20.65 20.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.212 0.53 . . . . 0.0 110.525 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -77.7 -10.13 59.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.108 0.48 . . . . 0.0 110.44 173.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -110.75 -28.53 8.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.294 -178.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' A' ' 65' ' ' ILE . 13.5 p -62.64 121.38 11.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.53 0.681 . . . . 0.0 111.315 -176.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.1 m -85.09 -12.68 52.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.159 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.403 ' H ' HG22 ' A' ' 68' ' ' VAL . 26.1 t -102.23 124.04 41.12 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.056 -177.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.96 -34.45 59.41 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.897 2.398 . . . . 0.0 111.99 177.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 85.2 mmm -66.41 -37.47 85.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.179 -177.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 94.9 t -68.1 -41.23 84.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.539 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.26 91.63 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.37 177.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.466 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -59.61 -42.28 92.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.859 176.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -60.8 -45.11 95.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.021 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 66.8 mtt -57.47 -51.1 70.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.303 0.573 . . . . 0.0 110.728 178.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.492 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -73.23 -14.25 79.21 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.783 -177.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -73.32 -31.34 63.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.68 0.276 . . . . 0.0 110.534 -178.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -64.92 138.01 58.11 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.044 0.45 . . . . 0.0 111.384 -177.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.439 HH11 ' HD2' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.54 4.64 28.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.639 -177.04 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.1 m -83.44 -31.98 26.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 0.0 110.06 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.556 ' HG3' ' HE1' ' A' ' 56' ' ' PHE . 32.2 mmmt -65.14 146.88 98.86 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.862 177.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 32.4 Cg_exo -59.57 148.07 88.97 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.929 2.42 . . . . 0.0 112.598 178.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 98.2 mt -112.39 159.72 18.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.33 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.7 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 54.4 mtp180 -83.29 153.24 24.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.374 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.13 -34.06 75.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.883 0.373 . . . . 0.0 110.627 179.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.441 ' O ' HG22 ' A' ' 92' ' ' VAL . 10.5 p30 -100.87 12.95 36.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.31 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.7 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 55.0 t-105 -65.81 -17.56 64.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.145 0.498 . . . . 0.0 109.758 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -65.26 -39.48 92.68 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.341 176.673 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.0 p -99.17 -42.49 7.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.465 ' O ' HG23 ' A' ' 96' ' ' VAL . 32.6 m -67.96 -14.03 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -167.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.639 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 35.2 mtmm -51.87 -44.25 63.63 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.096 0.474 . . . . 0.0 111.131 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -80.46 -25.36 38.93 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.624 -175.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.445 ' OE1' ' HA ' ' A' ' 92' ' ' VAL . 1.7 mp0 -70.87 -40.68 72.14 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 174.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.481 HG11 ' HA ' ' A' ' 51' ' ' PHE . 84.3 t -63.96 -48.75 84.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.772 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.3 ttm -70.43 -30.67 67.59 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.303 -178.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.1 ttm-85 -63.9 -38.0 89.46 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -65.22 -42.82 93.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.627 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.91 -48.28 81.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.786 178.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.2 mt -62.46 -46.7 87.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.074 178.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.507 ' HA ' HD21 ' A' ' 152' ' ' LEU . 49.8 ttt85 -59.14 -51.98 67.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.555 -178.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -62.78 -29.85 71.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 0.0 111.151 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.509 ' HA ' HG22 ' A' ' 37' ' ' ILE . 88.3 tttt -64.2 -53.65 45.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.821 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 86.2 m-85 -77.69 -22.95 49.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.88 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.431 ' OE1' ' HG2' ' A' ' 102' ' ' ARG . 44.3 mt-10 -72.34 -49.88 30.96 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.128 -0.358 . . . . 0.0 110.917 175.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.2 OUTLIER -71.68 -26.03 62.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.893 -175.918 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -116.52 101.93 9.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.908 0.385 . . . . 0.0 110.111 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.13 75.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.816 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.4 pm0 -69.41 -30.52 68.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.805 0.336 . . . . 0.0 110.621 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 29.2 mt -74.59 -37.51 62.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.775 ' HG3' HD13 ' A' ' 156' ' ' LEU . 16.5 ttm180 -64.17 -44.29 92.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.924 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.93 -43.91 97.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.375 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.1 tp -57.68 -48.42 79.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.809 176.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.412 HD23 HD12 ' A' ' 156' ' ' LEU . 43.4 tp -57.65 -44.83 85.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.845 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.49 HD21 ' HB2' ' A' ' 156' ' ' LEU . 78.8 mt -69.5 -29.52 67.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.539 -178.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -70.31 -17.34 63.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.705 -178.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 47.5 p -72.61 -35.63 67.89 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.745 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -50.92 133.44 29.2 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.824 -179.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 48.4 Cg_endo -100.55 38.65 5.21 Favored 'Cis proline' 0 CA--C 1.535 0.574 0 C-N-CA 124.184 -1.173 . . . . 0.0 113.432 1.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -75.1 157.96 33.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.288 0.566 . . . . 0.0 111.099 178.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.689 ' HD3' HG13 ' A' ' 16' ' ' ILE . 86.7 tttt -95.39 122.8 38.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.264 -173.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.3 mt -90.27 119.27 30.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.787 0.327 . . . . 0.0 111.216 -175.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.515 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 60.5 t -136.75 119.36 20.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.731 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.499 ' HA ' ' O ' ' A' ' 19' ' ' PHE . 37.7 tt0 -97.38 116.94 30.54 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 171.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.556 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 1.4 t-80 -87.1 77.11 9.18 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.354 -170.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 17.1 m -86.37 107.7 18.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.105 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.9 -28.5 11.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.61 -178.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -55.89 -42.44 75.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.52 177.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -140.42 136.18 32.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.432 -177.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -100.41 87.51 3.42 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.925 0.393 . . . . 0.0 110.844 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -146.55 -45.29 0.19 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.592 ' HB3' HD22 ' A' ' 145' ' ' LEU . 85.9 m95 -131.2 107.27 8.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.434 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 129.15 -149.77 18.65 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.031 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.556 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 3.8 m-20 -73.03 -28.83 62.57 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.97 0.414 . . . . 0.0 111.646 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 70.16 10.17 65.06 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 110.209 -1.156 . . . . 0.0 110.209 -168.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 92.29 -12.51 69.48 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 114.826 -0.687 . . . . 0.0 113.537 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -144.45 0.75 1.03 Allowed 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -174.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 111.28 -50.49 0.77 Allowed Glycine 0 CA--C 1.517 0.196 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.619 178.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -81.45 61.31 4.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.706 0.765 . . . . 0.0 109.955 178.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -132.13 15.21 5.08 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.777 176.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt 70.44 79.61 0.18 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.326 0.584 . . . . 0.0 111.865 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -77.72 5.42 9.4 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.755 0.788 . . . . 0.0 110.12 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.637 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 46.1 mtm105 -62.98 -8.19 6.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.878 -177.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.592 HD22 ' HB3' ' A' ' 133' ' ' TRP . 66.5 tp -66.61 -49.09 67.44 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 168.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -59.09 -37.89 92.28 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 173.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . 0.41 ' HB3' ' HA ' ' A' ' 144' ' ' ARG . 88.2 t80 -63.75 -45.81 88.18 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.581 -0.31 . . . . 0.0 110.911 176.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 87.9 mt -56.77 -41.4 77.58 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.887 0.375 . . . . 0.0 110.399 178.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.96 -45.88 91.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.947 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.565 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 75.3 mtm -71.64 -36.57 70.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.235 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -62.81 -49.17 75.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.531 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.507 HD21 ' HA ' ' A' ' 102' ' ' ARG . 48.9 tp -66.16 -34.16 77.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.259 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 150' ' ' MET . 62.1 ttp180 -54.4 -48.81 71.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.693 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 150' ' ' MET . 5.7 mm-40 -59.96 -39.71 86.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.504 -178.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -63.78 -39.87 95.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.537 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.775 HD13 ' HG3' ' A' ' 112' ' ' ARG . 87.8 mt -78.29 -15.09 59.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.958 -178.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.419 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -79.69 -45.57 18.74 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 174.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 154' ' ' GLU . 63.5 mt -60.66 -29.28 44.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.104 177.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . 0.455 ' HB3' ' O ' ' A' ' 156' ' ' LEU . 5.5 tt0 -47.9 -53.83 14.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.408 174.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -80.71 -10.83 59.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.621 -174.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . 0.419 HD13 ' O ' ' A' ' 157' ' ' ALA . 8.2 mp -74.66 -22.01 59.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.022 0.439 . . . . 0.0 110.254 175.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.732 -179.986 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.3 t . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.597 0.237 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 44.4 mtm180 -115.44 97.2 6.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.314 -176.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.84 94.83 1.08 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 172.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.215 -174.234 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.2 t60 . . . . . 0 N--CA 1.453 -0.309 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.8 m -77.98 165.18 3.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.379 0.609 . . . . 0.0 111.291 176.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.732 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 13.8 mtt -95.39 50.42 1.24 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.047 -174.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 61.31 -94.88 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.886 -174.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -115.4 74.79 0.9 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.679 0.752 . . . . 0.0 109.317 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.732 ' HB ' ' HB2' ' A' ' 12' ' ' MET . 7.0 t -94.35 154.73 17.34 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.6 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.562 HG12 ' HB2' ' A' ' 122' ' ' LYS . 58.3 mt -111.1 123.6 67.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.029 0.443 . . . . 0.0 110.328 179.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.3 mt -101.7 105.57 18.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.107 -179.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.649 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 20.4 m120 -96.57 123.87 40.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.836 177.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -104.76 147.54 27.59 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.848 0.356 . . . . 0.0 110.863 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.599 ' HE1' ' O ' ' A' ' 126' ' ' HIS . 78.3 m-85 -126.99 114.29 17.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.652 -177.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.8 t 56.46 -150.18 0.44 Allowed 'General case' 0 CA--C 1.534 0.358 0 O-C-N 123.585 0.553 . . . . 0.0 109.702 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.515 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 26.0 p -89.45 -55.91 3.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 173.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.4 m 67.22 -69.68 0.13 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 174.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -129.9 179.75 5.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.181 -168.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -71.99 -27.4 62.73 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -73.38 -6.38 45.86 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.144 172.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.515 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -79.82 0.06 83.46 Favored Glycine 0 C--O 1.23 -0.129 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.653 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -49.14 -21.11 0.68 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -59.29 -21.8 60.22 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.947 0.403 . . . . 0.0 111.07 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.2 t -82.11 129.53 34.84 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.407 ' HB3' ' HB2' ' A' ' 47' ' ' SER . 42.0 m-80 -78.41 5.16 11.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.865 0.364 . . . . 0.0 111.514 -178.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -92.88 -3.17 55.07 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 175.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.16 136.66 52.45 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.925 176.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.68 60.82 4.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.42 0.629 . . . . 0.0 111.067 -174.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -104.02 120.88 49.68 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.591 175.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.484 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 30.8 Cg_endo -64.34 124.24 13.06 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.89 2.393 . . . . 0.0 112.523 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.6 HG22 ' HA ' ' A' ' 104' ' ' LYS . 25.9 pt -113.27 156.34 14.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.516 177.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -111.1 97.11 6.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.99 0.424 . . . . 0.0 110.258 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.545 HG13 ' HD3' ' A' ' 99' ' ' LYS . 87.8 t -119.04 122.85 70.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.23 -174.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 58.71 30.23 19.68 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 123.844 0.715 . . . . 0.0 110.839 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.5 14.82 75.26 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.754 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -126.16 143.13 51.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.894 0.347 . . . . 0.0 110.454 -179.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.3 m -91.5 115.74 28.29 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.348 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.503 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 72.9 m95 -105.23 133.18 20.28 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.926 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 8.9 Cg_exo -71.67 -11.26 27.76 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 123.071 2.514 . . . . 0.0 113.012 -177.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -165.6 146.6 7.06 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.407 ' HB2' ' HB3' ' A' ' 31' ' ' ASN . 14.7 m -57.59 -39.12 76.08 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.319 0.387 . . . . 0.0 111.107 178.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.406 ' OE1' ' HB2' ' A' ' 75' ' ' ALA . 41.4 tt0 -61.19 -28.01 68.83 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.675 -178.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.512 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 14.8 m80 -64.37 -44.74 90.41 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.847 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -74.19 -36.76 64.03 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.176 0.512 . . . . 0.0 110.005 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -61.61 -46.76 88.44 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.567 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.547 ' HB3' HD13 ' A' ' 65' ' ' ILE . 0.6 OUTLIER -71.72 -31.17 66.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.482 -178.941 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.4 ' HB1' ' HG2' ' A' ' 62' ' ' ARG . . . -65.97 -45.98 79.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.791 0.329 . . . . 0.0 111.001 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -77.2 -15.15 59.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.881 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 52' ' ' GLN . 87.1 tttt -63.22 -34.36 77.49 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.506 177.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -108.24 155.84 20.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.298 -178.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.696 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.5 pt? -108.1 11.84 27.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.13 -177.12 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -95.91 120.38 36.09 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 177.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.443 ' CD ' ' H ' ' A' ' 59' ' ' GLU . 1.5 mp0 -57.72 -43.51 85.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.606 -173.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 64' ' ' GLU . 86.3 tttt -64.76 -56.88 10.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.728 -176.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.424 ' CZ ' ' HE2' ' A' ' 83' ' ' LYS . 7.1 t80 -60.61 -35.74 76.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.197 0.522 . . . . 0.0 110.14 -178.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.543 ' HE ' ' HG3' ' A' ' 63' ' ' GLU . 2.6 tmm_? -58.48 -46.25 87.04 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.493 176.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.546 ' HA ' ' HB3' ' A' ' 66' ' ' ARG . 35.4 mt-10 -83.51 -7.17 59.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.917 -177.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 19.0 mm-40 -74.67 -39.32 62.08 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 169.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.547 HD13 ' HB3' ' A' ' 52' ' ' GLN . 54.7 mt -70.6 -26.19 28.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.602 175.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.546 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . 25.7 tpt180 -72.53 -29.58 63.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.506 172.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 25.9 ttm-85 -80.65 -37.41 30.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.889 -175.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.515 HG21 ' HB ' ' A' ' 73' ' ' VAL . 11.1 p -71.41 120.39 19.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.443 0.64 . . . . 0.0 111.332 -176.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.0 t -80.42 -36.19 34.05 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.533 178.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.7 m -69.72 124.35 90.42 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.744 -178.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.512 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 35.4 Cg_endo -65.53 -45.45 6.89 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.866 2.377 . . . . 0.0 113.083 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 25.0 ttt -63.75 -26.05 68.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.586 -174.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.515 ' HB ' HG21 ' A' ' 68' ' ' VAL . 54.2 t -72.53 -36.67 54.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.96 0.41 . . . . 0.0 110.16 178.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.98 -44.35 89.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.88 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.588 ' O ' ' HG2' ' A' ' 79' ' ' ARG . . . -57.45 -48.92 77.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.679 173.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -51.89 -64.06 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.842 -178.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -80.75 -4.88 56.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.134 0.493 . . . . 0.0 111.001 -175.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.52 -25.29 39.65 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 121.033 -0.604 . . . . 0.0 111.923 175.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.588 ' HG2' ' O ' ' A' ' 75' ' ' ALA . 58.6 mmt-85 -89.72 3.84 51.48 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 177.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -59.47 -42.85 92.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.798 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 71.25 -15.92 0.39 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.534 0.734 . . . . 0.0 112.341 173.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.1 m -90.27 23.61 2.84 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.219 0.533 . . . . 0.0 110.563 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.424 ' HE2' ' CZ ' ' A' ' 61' ' ' TYR . 12.3 mmmt -109.44 162.47 20.07 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 177.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.42 114.47 2.14 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.173 1.915 . . . . 0.0 112.154 178.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 92.5 mt -84.89 154.26 22.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.045 -177.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -82.34 144.8 30.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.957 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -69.39 -51.97 31.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.118 0.485 . . . . 0.0 111.011 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -86.59 27.56 0.95 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.939 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.465 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 41.3 t-105 -62.15 -23.42 66.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.571 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.448 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 40.5 mm-40 -76.18 -18.63 59.0 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.016 178.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.1 m -99.8 -19.13 16.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.858 -177.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.44 ' HB ' HG23 ' A' ' 96' ' ' VAL . 28.3 m -111.06 2.11 8.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -168.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 59.4 mttp -60.05 -59.91 4.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.448 0.642 . . . . 0.0 110.424 -179.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.567 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 1.4 pm0 -78.87 -17.19 56.01 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.04 -177.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.435 ' HB3' ' HA ' ' A' ' 92' ' ' VAL . 10.2 tt0 -77.75 -48.28 17.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.484 179.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.44 HG23 ' HB ' ' A' ' 92' ' ' VAL . 68.3 t -64.77 -40.85 90.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 120.963 0.411 . . . . 0.0 109.909 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.8 tpp -60.16 -39.08 85.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.483 177.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -63.59 -40.94 98.23 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.439 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.545 ' HD3' HG13 ' A' ' 39' ' ' VAL . 39.0 ttmt -63.48 -46.51 85.83 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 177.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.61 -43.58 98.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.643 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.704 ' HB3' HD22 ' A' ' 152' ' ' LEU . 35.4 mt -60.13 -49.63 76.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.464 178.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.594 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 32.1 ttt180 -64.84 -45.78 84.68 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.533 -178.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.44 -28.7 68.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.191 0.519 . . . . 0.0 110.786 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.6 ' HA ' HG22 ' A' ' 37' ' ' ILE . 53.9 tttm -70.24 -53.7 15.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.791 179.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -86.82 -0.03 55.69 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -177.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.864 ' HA ' HH21 ' A' ' 112' ' ' ARG . 1.8 mm-40 -92.08 -40.64 10.94 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.628 0.251 . . . . 0.0 110.846 172.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -71.26 -38.89 71.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.947 0.403 . . . . 0.0 110.758 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -109.33 110.19 21.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.155 -175.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.5 -24.03 63.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.176 176.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.445 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.4 mp0 -58.71 -54.17 50.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.718 176.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 27.9 mt -69.59 -35.53 75.42 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.478 -176.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.864 HH21 ' HA ' ' A' ' 106' ' ' GLU . 42.5 ttm180 -57.37 -47.47 81.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.876 178.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.74 95.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.643 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.0 tp -61.29 -47.53 85.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.507 178.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.27 -45.67 92.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.026 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.526 HD21 ' HB2' ' A' ' 156' ' ' LEU . 74.3 mt -68.43 -18.82 64.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.6 -177.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -77.9 -7.28 56.51 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 63.5 p -85.3 -32.73 22.36 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.514 -178.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.04 136.36 14.38 Favored Pre-proline 0 N--CA 1.467 0.42 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -100.4 35.54 7.16 Favored 'Cis proline' 0 C--N 1.349 0.567 0 C-N-CA 124.45 -1.063 . . . . 0.0 113.156 -1.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -66.26 149.5 50.26 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.652 0.263 . . . . 0.0 111.222 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.562 ' HB2' HG12 ' A' ' 16' ' ' ILE . 55.7 mttp -79.87 125.38 29.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.735 179.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 53.9 mt -90.62 100.97 13.72 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.649 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 98.8 t -133.45 126.86 52.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.962 -174.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.575 ' CD ' HG22 ' A' ' 127' ' ' THR . 0.0 OUTLIER -83.6 136.59 34.18 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 174.425 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.762 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 72.5 t60 -134.26 77.24 1.69 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.955 0.407 . . . . 0.0 110.051 172.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.575 HG22 ' CD ' ' A' ' 125' ' ' GLU . 8.9 t -112.97 130.46 56.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.292 0.568 . . . . 0.0 109.544 175.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.506 ' HG2' ' CA ' ' A' ' 137' ' ' GLY . 29.2 mt-10 -87.81 12.35 13.2 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.436 -175.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -91.24 -35.24 14.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.583 -178.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -152.44 135.6 15.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.78 0.324 . . . . 0.0 110.864 -177.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.563 ' HB2' ' HA3' ' A' ' 136' ' ' GLY . . . -110.58 91.72 3.77 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.298 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -153.75 -31.15 0.12 Allowed 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.115 -178.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.418 ' HB3' HD22 ' A' ' 145' ' ' LEU . 78.6 m95 -137.15 36.92 2.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.591 0.234 . . . . 0.0 111.54 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.502 ' HA3' ' CD ' ' A' ' 125' ' ' GLU . . . -174.08 -114.9 0.37 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.162 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.762 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 16.3 t70 -111.62 -33.73 6.27 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.895 0.379 . . . . 0.0 110.866 -176.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . 0.563 ' HA3' ' HB2' ' A' ' 131' ' ' ALA . . . 74.2 6.5 74.85 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.031 177.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.506 ' CA ' ' HG2' ' A' ' 128' ' ' GLU . . . 78.7 40.69 17.26 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.917 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -178.02 -22.68 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . 0.422 ' HA2' ' OD2' ' A' ' 135' ' ' ASP . . . 127.28 -44.11 1.27 Allowed Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.222 -0.989 . . . . 0.0 113.043 174.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -91.37 68.39 5.83 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.778 0.799 . . . . 0.0 109.163 -177.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.456 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -123.1 14.89 8.31 Favored Glycine 0 C--N 1.311 -0.838 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.842 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 75.8 mttt 61.74 69.77 0.62 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.28 0.562 . . . . 0.0 111.732 173.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.464 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 7.6 t30 -72.92 5.54 3.21 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.337 -174.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.593 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 77.8 mtm-85 -48.07 -24.21 1.03 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.418 HD22 ' HB3' ' A' ' 133' ' ' TRP . 50.7 tp -57.25 -56.05 26.77 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.656 0.265 . . . . 0.0 110.764 174.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.55 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -64.49 -30.43 77.85 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 121.282 -0.485 . . . . 0.0 111.895 178.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -64.58 -42.3 95.69 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 95.3 mt -61.5 -41.24 96.98 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.095 175.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.87 -38.77 89.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.025 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 63.9 mtt -60.46 -51.25 70.26 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.162 0.506 . . . . 0.0 110.217 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -64.6 -41.02 96.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.849 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.704 HD22 ' HB3' ' A' ' 101' ' ' LEU . 54.7 tp -62.34 -42.04 99.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 178.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -59.48 -56.27 24.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.539 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.6 -32.99 70.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.049 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -64.25 -40.03 95.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.789 177.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.526 ' HB2' HD21 ' A' ' 116' ' ' LEU . 96.0 mt -77.69 -22.98 49.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.985 0.421 . . . . 0.0 110.613 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.41 -50.37 26.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.045 174.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 80.7 mt -65.05 -26.25 39.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.402 178.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -52.76 -40.72 63.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.602 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -74.58 -30.62 61.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.827 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.7 mp -70.75 -33.54 70.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.215 0.531 . . . . 0.0 110.361 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 . . . . . 0 C--N 1.325 -0.496 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.176 174.143 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.234 0.27 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.839 ' HB2' ' HB3' ' A' ' 25' ' ' ASP . 21.6 ttt180 -128.04 50.5 2.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.107 0.48 . . . . 0.0 110.249 177.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.474 ' HA ' HD13 ' A' ' 114' ' ' LEU . . . -74.84 58.63 0.84 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.562 0.696 . . . . 0.0 110.063 174.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 . . . . . 0 C--N 1.324 -0.543 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.627 -177.668 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 35.7 t-80 . . . . . 0 N--CA 1.451 -0.379 0 CA-C-O 121.003 0.43 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.53 HG21 ' HD2' ' A' ' 120' ' ' PRO . 33.3 m -99.74 170.56 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.3 mtt -72.67 -74.53 0.16 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.618 0.723 . . . . 0.0 109.695 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -175.71 -56.45 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.955 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -125.59 72.59 1.28 Allowed 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.26 -1.337 . . . . 0.0 107.648 168.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.59 ' HB ' ' HB2' ' A' ' 121' ' ' ALA . 4.2 m -76.62 154.54 34.26 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.622 -170.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.9 mm -115.79 124.11 71.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.422 HG12 ' HB1' ' A' ' 121' ' ' ALA . 45.5 mm -106.9 101.72 12.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.029 178.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -100.48 104.43 15.82 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -118.01 137.98 52.51 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.45 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.579 ' CE1' ' HA ' ' A' ' 127' ' ' THR . 8.9 t80 -150.28 149.33 29.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.486 176.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.5 p 66.61 154.01 0.08 Allowed 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.669 1.188 . . . . 0.0 111.941 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.564 HG21 ' HA ' ' A' ' 33' ' ' ALA . 1.8 m -93.98 0.23 55.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.539 0.685 . . . . 0.0 109.841 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m -75.12 -32.15 61.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.397 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.83 161.03 24.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.468 177.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.839 ' HB3' ' HB2' ' A' ' 4' ' ' ARG . 2.8 m-20 -68.05 -24.68 65.1 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.637 -176.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -76.37 -1.36 26.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.788 175.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 30' ' ' SER . . . -65.98 -3.27 16.06 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.808 -0.633 . . . . 0.0 113.176 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -61.63 -30.29 70.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.122 0.461 . . . . 0.0 110.553 174.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -72.94 -23.82 60.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.852 177.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 27' ' ' GLY . 29.2 t -58.83 138.1 57.42 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.464 0.649 . . . . 0.0 111.48 -176.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -72.93 -17.09 61.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.705 177.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -90.51 -5.62 55.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.365 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.564 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -64.0 146.86 53.36 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.832 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.38 59.22 3.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.268 0.556 . . . . 0.0 111.719 -174.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -109.99 109.7 59.05 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.993 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.53 139.08 68.41 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.703 2.268 . . . . 0.0 112.178 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.497 HG22 ' HA ' ' A' ' 104' ' ' LYS . 27.2 pt -124.86 138.31 54.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.018 0.437 . . . . 0.0 111.275 -177.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.623 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 50.0 tptt -97.66 106.59 18.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.406 HG11 ' CZ ' ' A' ' 50' ' ' TYR . 15.9 t -126.44 126.84 69.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.45 -174.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 54.71 23.74 5.03 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 124.043 0.84 . . . . 0.0 112.141 173.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.04 -14.67 31.26 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.667 -0.777 . . . . 0.0 113.416 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -121.52 153.73 37.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.913 0.857 . . . . 0.0 111.322 -175.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 12.1 m -99.41 108.66 21.2 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.214 -176.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.472 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 48.3 m95 -97.99 135.18 21.54 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.607 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.585 ' O ' HG22 ' A' ' 46' ' ' THR . 11.4 Cg_exo -71.78 57.46 2.51 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.788 2.326 . . . . 0.0 112.412 176.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 45' ' ' PRO . 0.7 OUTLIER 92.98 170.11 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.672 1.589 . . . . 0.0 112.708 172.436 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 m -49.33 -47.82 46.93 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 114.33 -1.304 . . . . 0.0 112.517 -172.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -54.38 -33.53 59.38 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.917 0.389 . . . . 0.0 111.604 -175.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.413 ' CE1' ' HB2' ' A' ' 45' ' ' PRO . 44.7 m80 -75.66 -43.57 46.91 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 122.057 -0.402 . . . . 0.0 110.822 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.452 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 42.9 t80 -70.29 -26.28 63.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.952 0.406 . . . . 0.0 110.396 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.489 ' HA ' HG11 ' A' ' 96' ' ' VAL . 27.3 t80 -62.81 -52.87 61.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.512 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.78 ' HB3' HD13 ' A' ' 65' ' ' ILE . 2.4 mp0 -62.97 -34.39 77.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.594 174.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.684 ' HA ' ' HG2' ' A' ' 62' ' ' ARG . . . -65.72 -29.02 69.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.707 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.461 HE21 ' HA ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -105.41 2.92 29.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.124 0.487 . . . . 0.0 110.06 178.602 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -83.71 -57.94 3.01 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.214 174.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.579 ' CE1' ' HB2' ' A' ' 83' ' ' LYS . 57.0 m-85 -88.02 143.24 27.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.505 -179.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.759 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.5 pt? -102.08 8.71 40.74 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.631 0.253 . . . . 0.0 111.657 -175.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -89.43 121.74 31.96 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.27 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -59.03 -44.86 91.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.443 -176.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -68.47 -52.73 29.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.508 -174.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -67.28 -30.74 70.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.857 0.36 . . . . 0.0 110.864 -178.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.684 ' HG2' ' HA ' ' A' ' 53' ' ' ALA . 5.3 tmm_? -68.67 -34.46 75.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.298 0.57 . . . . 0.0 109.5 177.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -67.18 -27.76 67.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.534 175.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.429 ' O ' ' HB3' ' A' ' 67' ' ' ARG . 1.3 tp10 -72.74 -28.61 62.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.231 176.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.78 HD13 ' HB3' ' A' ' 52' ' ' GLN . 37.9 mt -77.05 -22.24 14.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.276 0.56 . . . . 0.0 110.595 177.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -76.69 -19.74 57.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 170.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' A' ' 64' ' ' GLU . 7.3 tpp180 -75.78 -43.53 46.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.605 -179.291 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.7 p -63.86 120.34 10.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.334 0.588 . . . . 0.0 110.423 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.2 m -86.0 -31.72 21.89 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.289 -177.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.425 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 35.5 t -72.32 123.37 89.41 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.77 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 17.0 Cg_exo -67.8 -34.41 24.35 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.74 2.293 . . . . 0.0 111.652 177.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.473 ' HA ' ' CE ' ' A' ' 72' ' ' MET . 2.2 tpt -67.48 -47.25 70.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.521 -178.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.8 t -65.3 -37.48 80.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.46 -47.55 83.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.83 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.534 ' O ' ' HG3' ' A' ' 79' ' ' ARG . . . -66.7 -41.13 88.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.443 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.3 tpt180 -55.3 -53.73 52.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.032 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -80.2 -23.78 40.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.815 0.34 . . . . 0.0 110.775 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.56 -8.24 85.91 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.955 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 75' ' ' ALA . 89.7 mtt180 -89.34 -6.83 56.34 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 122.392 -0.475 . . . . 0.0 110.921 175.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -71.87 125.26 26.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.011 0.434 . . . . 0.0 109.955 176.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.659 ' HG3' HD11 ' A' ' 85' ' ' LEU . 14.5 ttm180 -96.9 15.58 21.82 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.554 -174.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.1 m -91.74 -8.04 48.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.931 178.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.579 ' HB2' ' CE1' ' A' ' 56' ' ' PHE . 45.2 mmtm -88.77 162.32 38.99 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.422 176.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 51.5 Cg_endo -68.7 100.92 0.72 Allowed 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 121.883 1.722 . . . . 0.0 112.532 -178.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.659 HD11 ' HG3' ' A' ' 81' ' ' ARG . 97.1 mt -84.35 150.13 25.58 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.686 174.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -82.28 143.35 31.38 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 174.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -57.99 -31.43 66.92 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -169.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -104.6 21.99 15.81 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 121.031 -0.268 . . . . 0.0 111.296 -176.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.451 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 43.3 t-105 -58.43 -48.53 80.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.451 -177.117 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.967 ' HA ' ' HE3' ' A' ' 93' ' ' LYS . 1.0 OUTLIER -55.99 -23.38 32.3 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -177.164 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.0 p -99.91 -17.37 17.62 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.9 m -105.53 7.05 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.967 ' HE3' ' HA ' ' A' ' 90' ' ' GLU . 97.6 mttt -59.5 -41.9 90.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.086 0.47 . . . . 0.0 111.061 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.494 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 5.0 pt-20 -73.0 -24.33 60.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.161 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -72.3 -43.36 64.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.162 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.489 HG11 ' HA ' ' A' ' 51' ' ' PHE . 62.7 t -62.12 -38.64 81.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.197 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 21.8 mmt -59.62 -38.84 82.41 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.814 176.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.494 ' HG3' ' O ' ' A' ' 94' ' ' GLU . 81.7 mtt180 -59.05 -44.97 91.87 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.996 0.427 . . . . 0.0 110.773 177.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 tmtp? -66.72 -49.52 65.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.575 -178.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.26 68.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.72 -176.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.493 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 41.7 mt -64.58 -36.14 83.26 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -177.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.571 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 70.8 ttt180 -65.09 -53.62 42.7 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.784 177.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.44 -32.93 67.4 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.99 0.424 . . . . 0.0 110.82 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.497 ' HA ' HG22 ' A' ' 37' ' ' ILE . 58.7 tttp -54.51 -52.78 60.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.958 175.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -82.42 -30.92 29.85 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.605 ' HA ' ' NH2' ' A' ' 112' ' ' ARG . 28.6 mm-40 -63.46 -49.15 74.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.59 0.233 . . . . 0.0 111.604 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.623 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 79.6 mm-40 -74.47 -20.88 59.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -175.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -116.1 105.02 12.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.808 0.337 . . . . 0.0 111.17 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.54 -27.75 69.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.194 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.445 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.5 mp0 -57.17 -51.27 70.0 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.69 175.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 67.2 mt -73.05 -39.18 66.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.958 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.605 ' NH2' ' HA ' ' A' ' 106' ' ' GLU . 35.1 ttm-85 -57.9 -44.73 86.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.856 0.36 . . . . 0.0 110.569 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.27 -41.26 94.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.806 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 5' ' ' ALA . 57.8 tp -62.53 -41.83 99.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.54 178.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 62.0 tp -65.16 -40.25 94.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.892 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.478 HD21 ' HB2' ' A' ' 156' ' ' LEU . 43.3 mt -81.05 -6.41 58.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.772 0.32 . . . . 0.0 111.042 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.31 -31.99 22.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.069 177.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.9 p -72.9 -21.82 60.84 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.211 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.531 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -52.48 139.0 39.29 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.439 178.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.53 ' HD2' HG21 ' A' ' 11' ' ' VAL . 41.2 Cg_endo -100.1 40.66 4.16 Favored 'Cis proline' 0 CA--C 1.534 0.519 0 C-N-CA 124.371 -1.095 . . . . 0.0 113.241 -0.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.59 ' HB2' ' HB ' ' A' ' 15' ' ' THR . . . -66.77 154.69 40.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.302 0.572 . . . . 0.0 112.108 -177.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.31 119.21 23.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.61 179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 23.3 mt -86.31 112.78 21.73 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.804 0.335 . . . . 0.0 110.67 -176.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.8 t -129.13 127.24 65.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.073 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -97.55 129.19 44.71 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -91.22 77.36 5.95 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.579 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -77.57 86.22 3.9 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.966 -177.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -76.62 -18.25 58.71 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.769 -175.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -90.53 -29.88 17.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.622 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . 0.441 ' O ' ' HB ' ' A' ' 127' ' ' THR . 8.9 t70 -145.51 138.87 26.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.816 -172.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.532 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -99.86 86.01 3.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 176.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -151.7 -34.87 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.954 -177.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.652 ' HB3' HD22 ' A' ' 145' ' ' LEU . 71.1 m95 -119.12 -0.23 11.12 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -172.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -155.39 -120.83 0.72 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 119.631 -1.271 . . . . 0.0 113.19 -172.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.516 ' HB2' ' HA2' ' A' ' 139' ' ' GLY . 1.2 p-10 -105.54 -10.21 17.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.957 0.408 . . . . 0.0 110.83 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 72.2 12.32 76.03 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.52 174.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 80.2 19.57 69.17 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.879 -178.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -163.42 19.21 0.07 Allowed 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . 0.516 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 79.86 -0.44 82.49 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 120.579 -0.82 . . . . 0.0 114.306 174.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -138.2 72.02 1.4 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.445 0.623 . . . . 0.0 110.121 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.532 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -129.07 15.15 5.88 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.558 -172.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.401 ' C ' ' H ' ' A' ' 144' ' ' ARG . 33.0 tttm 68.17 80.35 0.2 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.0 0.905 . . . . 0.0 110.523 179.197 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.38 5.33 1.81 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 114.363 -1.29 . . . . 0.0 110.906 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.659 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 24.5 ttt180 -48.09 -26.83 2.0 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.201 0.6 . . . . 0.0 112.576 -176.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 133' ' ' TRP . 37.6 tp -64.22 -48.57 75.35 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.058 0.456 . . . . 0.0 110.108 178.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -64.76 -29.05 74.21 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.549 177.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -70.2 -38.8 75.4 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 176.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.659 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 89.5 mt -58.26 -49.82 75.77 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.249 0.547 . . . . 0.0 109.531 174.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.49 HD21 HD13 ' A' ' 101' ' ' LEU . 96.4 mt -65.21 -31.3 72.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.881 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.6 tpp -61.92 -53.04 61.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.085 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -69.26 -33.97 74.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.538 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.428 ' O ' ' HG2' ' A' ' 155' ' ' GLN . 61.7 tp -60.74 -46.14 91.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.058 0.456 . . . . 0.0 110.071 175.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.531 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 54.0 ttp85 -58.83 -49.54 77.32 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.029 177.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . 0.466 ' O ' HG13 ' A' ' 158' ' ' ILE . 44.4 mt-10 -71.66 -32.04 67.47 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -176.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 152' ' ' LEU . 9.3 pt20 -71.66 -32.19 67.64 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.427 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.478 ' HB2' HD21 ' A' ' 116' ' ' LEU . 84.5 mt -73.78 -25.81 60.32 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.462 ' O ' ' HB3' ' A' ' 160' ' ' LYS . . . -72.18 -43.64 64.24 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.055 173.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.508 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 87.2 mt -62.91 -42.91 98.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 175.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -58.14 -31.35 67.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.107 175.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . 0.987 ' HA ' ' HE3' ' A' ' 160' ' ' LYS . 0.4 OUTLIER -66.86 -40.28 87.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.929 177.26 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.32 -23.31 65.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.666 177.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 158' ' ' ILE . 22.7 mm-40 . . . . . 0 C--N 1.323 -0.577 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.167 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.5 t . . . . . 0 N--CA 1.452 -0.336 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 4' ' ' ARG . 24.8 ttp85 60.23 54.02 4.19 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.19 178.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.1 77.66 4.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.228 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.953 -179.852 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 . . . . . 0 N--CA 1.454 -0.244 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.405 HG21 ' HD2' ' A' ' 120' ' ' PRO . 35.0 m -59.46 146.7 9.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.277 0.56 . . . . 0.0 111.308 -179.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.4 mtm -94.14 22.66 5.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.391 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 68.42 -70.05 0.14 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.549 -173.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -77.9 44.79 0.48 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.88 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.9 m -97.75 113.32 25.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.625 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.7 mt -111.41 105.75 19.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 176.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 71.3 mt -92.67 102.02 13.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.728 -173.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.601 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 6.2 p30 -103.19 133.94 47.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.674 177.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -140.39 141.54 35.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.035 -175.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.668 ' O ' ' HB2' ' A' ' 21' ' ' SER . 6.6 t80 -150.27 100.22 2.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.182 165.083 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.668 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 6.0 t 150.19 110.7 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 124.85 1.344 . . . . 0.0 108.013 179.186 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.693 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 2.9 m -74.43 -70.26 0.41 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.1 m 47.46 -92.57 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.805 0.842 . . . . 0.0 113.087 174.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -157.24 27.27 0.3 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.524 0.678 . . . . 0.0 109.246 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.409 ' HA ' ' NH2' ' A' ' 4' ' ' ARG . 3.6 t70 -117.94 -153.16 0.52 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.166 -173.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -66.84 -1.31 3.78 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.018 0.437 . . . . 0.0 111.165 177.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.693 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -65.48 -0.45 6.29 Favored Glycine 0 C--O 1.225 -0.44 0 CA-C-N 115.749 -0.66 . . . . 0.0 113.504 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -56.48 -26.87 55.53 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 117.296 0.548 . . . . 0.0 111.315 175.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -66.55 -24.91 66.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.625 177.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.4 m -69.41 128.97 38.44 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 174.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 -76.09 10.52 1.89 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -172.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -95.01 2.2 55.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.223 0.535 . . . . 0.0 109.65 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.24 129.76 41.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.872 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.439 ' HA ' HG23 ' A' ' 46' ' ' THR . . . -86.8 62.89 7.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.414 0.626 . . . . 0.0 111.037 -174.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -102.15 125.51 36.36 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.563 175.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -61.61 116.78 3.65 Favored 'Trans proline' 0 C--O 1.239 0.563 0 C-N-CA 122.377 2.051 . . . . 0.0 111.119 174.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.586 HG22 ' HA ' ' A' ' 104' ' ' LYS . 26.1 pt -116.94 132.77 65.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.963 -178.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.548 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 5.0 tppp? -91.76 103.85 16.36 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 177.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.7 t -121.31 115.21 45.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.676 -177.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 64.64 14.82 9.3 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.568 176.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 114.57 -12.56 20.96 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.114 177.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -110.43 143.86 40.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 117.282 0.541 . . . . 0.0 111.564 -177.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.7 m -92.72 103.62 15.97 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.189 178.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.512 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 66.4 m95 -91.18 134.29 30.18 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.512 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 5.1 Cg_exo -76.44 -1.36 11.42 Favored 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 123.05 2.5 . . . . 0.0 112.743 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.439 HG23 ' HA ' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -169.73 150.31 3.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.202 -178.704 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.9 m -58.1 -40.68 81.78 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.318 0.386 . . . . 0.0 110.426 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.464 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 14.4 tp10 -57.68 -31.32 66.23 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.511 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.453 ' HE2' HG13 ' A' ' 68' ' ' VAL . 10.2 m80 -64.96 -43.9 91.15 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 122.074 -0.391 . . . . 0.0 111.138 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -72.3 -35.28 68.62 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 177.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.571 ' CD2' ' HE3' ' A' ' 55' ' ' LYS . 1.7 t80 -60.3 -46.5 89.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.557 177.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.601 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 79.2 mm-40 -57.88 -46.19 85.25 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.444 175.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.95 -33.4 68.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.521 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.42 ' HB3' ' HZ3' ' A' ' 89' ' ' TRP . 1.6 tp-100 -92.13 -14.58 28.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.741 -178.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.571 ' HE3' ' CD2' ' A' ' 51' ' ' PHE . 91.8 mttt -67.73 -38.52 83.65 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.044 0.45 . . . . 0.0 111.141 178.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -110.45 139.41 45.7 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.844 -174.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.847 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.8 pt? -89.53 -7.87 53.99 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.626 -175.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -73.03 138.83 46.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.949 0.404 . . . . 0.0 110.714 -177.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -72.0 -39.48 69.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.781 -175.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -82.86 -36.03 25.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.793 0.33 . . . . 0.0 110.54 -174.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.526 ' O ' HG12 ' A' ' 65' ' ' ILE . 4.9 t80 -66.52 -37.66 85.51 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.138 178.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 38.4 ttp-105 -66.78 -37.62 84.93 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.662 0.744 . . . . 0.0 109.696 174.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 34.0 tt0 -63.27 -33.19 74.97 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.294 175.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.421 ' OE2' ' HD2' ' A' ' 67' ' ' ARG . 5.7 tp10 -69.25 -36.1 76.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.965 177.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.526 HG12 ' O ' ' A' ' 61' ' ' TYR . 50.3 mm -60.66 -34.11 57.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.391 176.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -65.36 -32.92 74.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.973 175.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 45.9 mtt180 -81.7 -33.2 31.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.789 -172.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.453 HG13 ' HE2' ' A' ' 49' ' ' HIS . 7.2 p -68.8 112.57 3.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.351 0.596 . . . . 0.0 111.482 -176.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.6 m -71.98 -40.38 68.63 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.01 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 19.4 m -81.45 132.95 54.07 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.719 -173.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 20.9 Cg_exo -67.03 -44.18 5.52 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 123.179 2.586 . . . . 0.0 112.943 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.3 tpt -67.63 -36.8 81.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.753 0.311 . . . . 0.0 110.947 -173.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 67.2 t -62.71 -43.15 98.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.304 178.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.28 -43.43 91.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.399 177.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.64 -39.9 95.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.891 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.466 ' HD3' ' C ' ' A' ' 76' ' ' ARG . 1.9 tmt_? -61.52 -53.88 50.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.711 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -74.48 -15.61 60.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.777 0.322 . . . . 0.0 111.178 -176.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.601 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -93.94 -5.32 62.69 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.341 175.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 44.2 ttt180 -98.79 -5.84 30.44 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -81.54 118.92 23.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.686 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 34.0 ttm105 -92.95 66.73 4.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.503 0.668 . . . . 0.0 110.604 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 95.0 p -138.69 8.0 2.56 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.707 0.765 . . . . 0.0 109.06 167.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -99.99 160.05 28.22 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.535 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.46 101.61 0.54 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.151 1.9 . . . . 0.0 111.509 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 69.0 mt -77.5 136.82 38.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.899 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.54 ' HB3' ' HB2' ' A' ' 89' ' ' TRP . 16.8 ttt180 -66.98 131.81 46.64 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.425 ' HA ' ' HD2' ' A' ' 87' ' ' LYS . 20.1 tptp -62.9 -52.15 64.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.813 -172.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -89.64 20.34 4.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.501 0.191 . . . . 0.0 111.279 -177.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.54 ' HB2' ' HB3' ' A' ' 86' ' ' ARG . 63.7 t-105 -59.8 -33.35 71.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.947 0.403 . . . . 0.0 110.167 177.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.18 -40.65 77.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.333 179.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.5 p -85.82 -9.77 56.51 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -174.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.42 HG22 ' HA ' ' A' ' 89' ' ' TRP . 34.5 m -119.24 -4.43 10.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -176.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -53.21 -44.35 67.95 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.042 0.448 . . . . 0.0 111.676 -176.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 94' ' ' GLU . 5.6 pt-20 -83.28 -20.36 34.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.294 -175.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -75.43 -43.55 49.2 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 61.0 t -64.07 -41.89 93.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.99 177.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 52.6 tpp -58.51 -47.28 84.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.709 175.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -61.48 -42.78 99.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.954 -178.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.7 tttp -65.89 -45.36 82.3 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.817 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.55 -41.99 92.37 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.951 0.405 . . . . 0.0 110.73 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.474 ' HB3' HD22 ' A' ' 152' ' ' LEU . 17.5 mt -58.62 -48.65 80.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.309 177.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.9 ttt85 -58.97 -40.92 86.22 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.711 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.23 -37.15 82.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.126 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.586 ' HA ' HG22 ' A' ' 37' ' ' ILE . 27.1 ttpp -65.69 -42.69 90.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.64 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.603 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 82.3 m-85 -82.5 -24.12 34.32 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -77.74 -41.25 38.33 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 121.867 -0.521 . . . . 0.0 111.112 176.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.728 HE21 ' N ' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -83.31 -11.06 58.11 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.513 -176.276 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -129.24 105.25 8.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.048 0.451 . . . . 0.0 109.937 173.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.49 -30.32 70.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.025 -174.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -69.49 -34.2 73.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.814 0.34 . . . . 0.0 110.397 -179.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 36.2 mt -73.0 -38.19 66.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.611 177.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.603 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 22.7 ttm180 -59.8 -46.36 89.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.178 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.09 97.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.843 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.6 tp -58.13 -50.92 71.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.465 176.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 51.3 tp -58.74 -51.29 70.59 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.546 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.497 HD21 ' HB2' ' A' ' 156' ' ' LEU . 31.3 mt -68.5 -22.33 64.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.604 -174.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -78.26 -11.91 59.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.842 -178.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 68.8 p -80.52 -29.07 37.24 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.944 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -50.84 135.18 27.66 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.951 -178.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 68.9 Cg_endo -100.45 27.18 15.21 Favored 'Cis proline' 0 N--CA 1.458 -0.562 0 C-N-CA 124.338 -1.109 . . . . 0.0 113.2 0.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -58.57 150.94 21.67 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 120.92 0.39 . . . . 0.0 111.725 -177.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -87.29 117.71 26.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.49 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 31.6 mt -88.04 127.4 35.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.07 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.601 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 1.8 p -142.85 119.18 5.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.211 0.529 . . . . 0.0 111.007 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -91.57 131.52 36.93 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -91.99 77.13 5.43 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 119.544 -0.862 . . . . 0.0 108.767 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.73 86.13 5.35 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.544 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -85.96 -15.62 40.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.073 -176.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -82.98 -25.43 32.27 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.204 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -152.05 129.65 11.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.594 -176.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.51 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -100.03 85.71 3.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.867 -178.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -158.96 -26.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -177.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.523 ' HB3' HD22 ' A' ' 145' ' ' LEU . 49.1 m95 -131.52 22.01 4.72 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -168.01 -134.27 1.69 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 119.319 -1.42 . . . . 0.0 113.695 -177.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -76.09 -34.45 59.52 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.076 0.465 . . . . 0.0 111.095 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . 0.52 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 79.67 -2.4 73.5 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.651 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 84.93 9.91 79.8 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 121.277 -0.487 . . . . 0.0 112.499 179.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . 0.467 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 30.0 p80 -168.19 23.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.525 0.203 . . . . 0.0 111.103 -178.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 88.14 -51.45 4.0 Favored Glycine 0 CA--C 1.522 0.473 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.591 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.467 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 95.1 mttt -84.53 62.64 7.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.697 0.761 . . . . 0.0 110.655 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.52 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -123.41 15.25 8.13 Favored Glycine 0 C--N 1.315 -0.627 0 CA-C-N 115.221 -0.899 . . . . 0.0 112.548 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' A' ' 142' ' ' LYS . 11.1 mptt 63.02 71.33 0.52 Allowed 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 122.962 0.505 . . . . 0.0 111.506 172.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.561 ' OD1' HG23 ' A' ' 124' ' ' VAL . 6.3 t30 -71.92 5.71 2.47 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.284 -178.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.469 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 2.6 mpt_? -49.89 -22.05 1.37 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -179.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.523 HD22 ' HB3' ' A' ' 133' ' ' TRP . 62.8 tp -59.23 -45.5 90.98 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.613 0.244 . . . . 0.0 110.598 175.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.604 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -63.52 -30.83 78.77 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.751 176.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -71.77 -36.97 70.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 98.2 mt -62.14 -36.79 82.86 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 174.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.34 -38.81 92.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.337 174.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.604 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 58.1 mtt -64.04 -46.53 84.01 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 177.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -56.54 -51.08 69.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.583 177.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.474 HD22 ' HB3' ' A' ' 101' ' ' LEU . 56.4 tp -63.55 -48.42 77.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.879 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -56.77 -41.07 76.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.872 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . 0.445 ' O ' HG13 ' A' ' 158' ' ' ILE . 1.4 tp10 -61.39 -52.54 64.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.151 -178.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -65.34 -35.48 81.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.53 -175.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.497 ' HB2' HD21 ' A' ' 116' ' ' LEU . 87.4 mt -72.47 -35.01 68.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.856 0.36 . . . . 0.0 110.317 179.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.411 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -68.43 -47.85 66.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.506 177.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 154' ' ' GLU . 73.4 mt -62.24 -37.95 79.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.422 179.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -63.3 -31.8 73.05 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.34 0.59 . . . . 0.0 110.09 177.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -82.77 -12.27 57.64 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.716 179.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 157' ' ' ALA . 7.8 mp -96.51 -35.55 11.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.839 177.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.874 -177.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.457 ' HA ' ' CG ' ' A' ' 25' ' ' ASP . 56.8 t . . . . . 0 C--O 1.235 0.331 0 CA-C-O 121.051 0.453 . . . . 0.0 111.955 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.42 HH21 ' CG ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -83.65 86.45 7.12 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 173.908 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.64 76.55 10.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.066 -175.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 . . . . . 0 C--N 1.323 -0.565 0 CA-C-O 121.267 0.556 . . . . 0.0 109.706 176.746 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-O 120.875 0.369 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 5.5 m -83.47 149.62 4.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 171.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.429 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 0.6 OUTLIER -66.21 -80.21 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.072 -176.645 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.429 ' H ' ' HB2' ' A' ' 12' ' ' MET . 49.2 tt0 -169.32 83.38 0.13 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 173.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.3 t70 62.9 99.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.968 0.793 . . . . 0.0 110.114 -173.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.9 t -120.56 148.08 44.33 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.63 HG13 ' HD2' ' A' ' 122' ' ' LYS . 3.9 mp -86.34 104.74 14.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.968 0.413 . . . . 0.0 110.049 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.6 mt -90.03 89.93 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-O 121.281 0.562 . . . . 0.0 109.881 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.4 p30 -84.16 102.06 12.3 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 171.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -100.7 137.27 39.32 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.625 -171.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -150.72 -179.34 7.18 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.578 175.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 48.2 m 66.48 93.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.671 0.748 . . . . 0.0 110.666 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.439 HG21 ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -81.39 3.41 24.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.962 -176.025 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 m -46.12 -47.47 17.39 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.348 -0.842 . . . . 0.0 113.255 -175.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.42 ' CG ' HH21 ' A' ' 4' ' ' ARG . 2.6 p-10 -115.11 -175.47 2.7 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.921 -0.487 . . . . 0.0 110.996 -179.478 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.457 ' CG ' ' HA ' ' A' ' 3' ' ' VAL . 5.0 m-20 -66.35 -26.39 67.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.915 -172.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -70.05 -15.57 63.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.292 0.568 . . . . 0.0 110.277 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -87.17 -0.27 85.3 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.222 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.87 -25.78 63.64 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -56.95 -25.83 58.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.7 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.3 m -70.3 141.85 52.3 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.949 0.404 . . . . 0.0 110.486 177.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -59.06 -33.34 70.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.221 0.534 . . . . 0.0 110.971 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -85.96 20.86 2.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.31 -173.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.439 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -70.21 138.65 51.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.787 0.327 . . . . 0.0 111.144 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.541 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -94.53 64.86 3.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.384 -175.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -117.17 122.87 30.65 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.992 174.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.14 127.66 24.91 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 122.864 2.376 . . . . 0.0 112.532 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.543 ' CG2' ' HA ' ' A' ' 104' ' ' LYS . 11.6 pt -123.9 141.61 43.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.053 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -102.57 87.83 3.09 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.472 HG22 ' HB3' ' A' ' 103' ' ' ALA . 16.0 t -108.41 130.07 61.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.838 -173.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 t70 64.87 26.39 12.87 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.777 0.673 . . . . 0.0 110.159 175.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 77.69 14.36 82.49 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.147 -178.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.9 mttp -125.46 148.71 48.73 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -176.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 35.9 m -93.16 126.46 38.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.702 0.287 . . . . 0.0 111.193 -178.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.446 ' HB2' HG13 ' A' ' 37' ' ' ILE . 35.4 m95 -125.59 133.55 24.99 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.322 178.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 11.9 Cg_exo -71.08 -29.95 16.98 Favored 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 122.763 2.309 . . . . 0.0 112.433 178.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.541 HG22 ' HA ' ' A' ' 34' ' ' ALA . 4.8 p -145.92 169.63 18.22 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.326 -177.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 m -69.42 -44.99 70.24 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.4 0.437 . . . . 0.0 111.971 -173.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.412 ' CD ' ' HG1' ' A' ' 46' ' ' THR . 0.4 OUTLIER -67.35 -15.17 63.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -173.814 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.413 ' O ' HG21 ' A' ' 65' ' ' ILE . 10.5 m80 -63.55 -52.18 62.21 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 174.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -65.96 -37.01 84.9 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.148 0.499 . . . . 0.0 109.931 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.53 -50.11 70.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.424 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -69.84 -37.03 76.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.382 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.597 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -62.83 -54.49 38.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.058 -175.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -73.63 -26.88 60.98 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.804 0.335 . . . . 0.0 110.417 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -56.07 -45.41 79.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.358 172.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -76.09 124.25 27.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.98 176.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.841 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.0 OUTLIER -81.05 -15.64 55.52 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.775 179.552 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -78.01 126.23 30.52 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 62' ' ' ARG . 10.7 tp10 -67.22 -38.17 84.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.504 -173.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.412 ' O ' ' HB3' ' A' ' 63' ' ' GLU . 41.7 mttm -83.41 -25.4 31.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -175.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.534 ' OH ' ' HE3' ' A' ' 83' ' ' LYS . 0.3 OUTLIER -80.82 -23.28 39.32 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.355 -0.938 . . . . 0.0 109.918 173.785 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.597 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 24.9 ttp180 -68.98 -35.58 76.89 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 167.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.412 ' HB3' ' O ' ' A' ' 60' ' ' LYS . 42.1 tt0 -64.83 -36.24 83.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.037 174.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.433 ' CD ' HH21 ' A' ' 67' ' ' ARG . 5.9 tp10 -58.93 -42.89 90.83 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.434 173.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.413 HG21 ' O ' ' A' ' 49' ' ' HIS . 45.6 mm -60.35 -37.13 73.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.979 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -72.15 -32.11 66.59 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.028 0.442 . . . . 0.0 110.415 175.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.433 HH21 ' CD ' ' A' ' 64' ' ' GLU . 35.1 ttp180 -70.57 -26.5 63.56 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.177 -175.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.2 m -87.49 121.97 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 121.485 0.66 . . . . 0.0 110.987 178.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.0 p -83.33 -13.42 55.12 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 173.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.9 m -85.89 117.48 68.8 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.455 -176.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.64 -46.62 0.82 Allowed 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 123.056 2.504 . . . . 0.0 111.954 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.9 tpt -62.51 -33.07 74.15 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.295 -176.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 93.9 t -69.29 -43.36 81.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.199 178.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.71 -38.74 92.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.619 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.99 -45.97 86.64 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.864 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 76' ' ' ARG . 42.4 mtm180 -62.59 -48.22 80.37 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.634 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.777 ' HA ' ' HB2' ' A' ' 80' ' ' ASP . 26.6 ptt? -75.47 -11.06 59.96 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.458 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.32 -32.01 65.56 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.284 -0.726 . . . . 0.0 111.284 169.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -96.64 11.13 36.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.613 0.244 . . . . 0.0 110.918 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.777 ' HB2' ' HA ' ' A' ' 77' ' ' MET . 28.1 t70 -67.2 -19.54 65.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.738 -175.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 74.29 -41.29 0.47 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.653 0.781 . . . . 0.0 111.966 177.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.8 m -83.06 33.15 0.44 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.183 0.516 . . . . 0.0 111.176 -178.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.534 ' HE3' ' OH ' ' A' ' 61' ' ' TYR . 47.4 mmtm -123.32 158.78 57.38 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.698 -178.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.18 103.04 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.603 2.202 . . . . 0.0 112.754 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 83' ' ' LYS . 73.7 mt -105.55 154.49 20.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.978 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.563 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 52.7 mtt180 -99.03 136.27 39.24 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.88 0.371 . . . . 0.0 110.866 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -60.95 -33.7 73.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.855 175.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -95.91 11.45 33.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.99 -176.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 61.8 t-105 -63.92 -33.58 76.04 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.479 -174.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.82 -23.52 66.7 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.921 0.391 . . . . 0.0 110.681 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.7 m -91.87 -46.05 8.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.235 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.78 2.36 5.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.662 0.268 . . . . 0.0 111.705 -175.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 89' ' ' TRP . 35.1 ttmt -55.75 -53.64 54.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.597 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -62.46 -35.0 77.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.089 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -66.63 -51.59 54.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.696 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.2 t -64.31 -40.57 89.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.29 178.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.481 ' HA ' ' CE ' ' A' ' 97' ' ' MET . 2.1 tpt -59.29 -48.85 80.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.677 178.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 44.5 ttp180 -62.48 -35.85 80.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.321 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -64.04 -45.57 88.26 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.153 0.501 . . . . 0.0 110.248 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.52 -42.98 95.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.549 177.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 97' ' ' MET . 92.8 mt -62.05 -36.16 80.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.156 178.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.518 ' HG3' HD11 ' A' ' 152' ' ' LEU . 59.2 ttp85 -62.63 -49.17 76.23 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.186 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.508 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -66.83 -29.75 69.76 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.185 0.517 . . . . 0.0 110.236 -178.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.543 ' HA ' ' CG2' ' A' ' 37' ' ' ILE . 57.5 tttp -59.91 -59.18 5.83 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.296 177.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.51 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 90.2 m-85 -80.07 -40.54 27.43 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.542 ' HA ' ' HD3' ' A' ' 112' ' ' ARG . 2.4 tm-20 -69.73 -37.99 76.69 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 121.154 -0.219 . . . . 0.0 111.385 -173.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.1 tp-100 -65.05 -35.74 82.14 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.045 0.45 . . . . 0.0 110.552 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -108.83 101.45 10.56 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.91 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -53.25 -34.42 57.08 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 112.077 -175.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.78 -44.91 86.56 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.068 177.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 68.1 mt -73.73 -38.87 64.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.525 -177.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.702 ' HG3' HD13 ' A' ' 156' ' ' LEU . 41.9 ttp180 -62.15 -47.98 82.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.531 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.81 -34.67 77.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.023 0.44 . . . . 0.0 110.391 178.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 50.5 tp -63.29 -41.62 98.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.15 177.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 32.2 tp -63.49 -49.25 74.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.304 178.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.98 -19.16 65.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.556 -178.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.29 11.21 12.68 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.5 0.555 . . . . 0.0 112.5 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 75.7 p -101.41 -25.39 13.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.887 0.375 . . . . 0.0 110.762 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.443 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -51.33 137.99 28.91 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.691 -178.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.44 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 90.2 Cg_endo -99.41 31.25 11.35 Favored 'Cis proline' 0 N--CA 1.458 -0.567 0 C-N-CA 124.276 -1.135 . . . . 0.0 113.306 -0.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.23 154.44 38.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.764 0.316 . . . . 0.0 111.274 -178.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.63 ' HD2' HG13 ' A' ' 16' ' ' ILE . 61.4 mttp -80.01 134.55 36.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.075 179.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.458 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 80.8 mt -102.97 113.69 27.37 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.125 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.51 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 26.6 t -131.95 116.25 29.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.503 -178.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -78.87 111.99 15.58 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 174.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.616 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 86.4 t60 -91.61 77.27 5.68 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -177.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.473 HG23 ' O ' ' A' ' 127' ' ' THR . 10.4 t -83.63 92.08 7.59 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 122.328 1.061 . . . . 0.0 109.106 177.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -79.96 59.22 3.14 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.189 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -144.48 -51.55 0.29 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.584 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -153.67 128.91 9.75 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.184 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.575 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -76.76 105.47 7.84 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.068 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -151.03 -46.14 0.12 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 120.642 -0.423 . . . . 0.0 112.128 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.702 ' HB3' HD22 ' A' ' 145' ' ' LEU . 7.8 m95 -126.54 35.19 4.68 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -176.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -172.31 -123.1 0.69 Allowed Glycine 0 CA--C 1.506 -0.519 0 C-N-CA 119.237 -1.459 . . . . 0.0 112.87 -177.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.518 ' HB2' ' HA2' ' A' ' 139' ' ' GLY . 1.5 p-10 -107.13 -17.11 14.25 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.308 0.575 . . . . 0.0 109.576 176.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . 0.424 ' HA3' ' HB2' ' A' ' 131' ' ' ALA . . . 64.6 18.94 64.32 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.773 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.616 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 86.11 10.89 74.01 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.042 -0.599 . . . . 0.0 113.303 -179.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -163.72 23.08 0.08 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 117.453 0.627 . . . . 0.0 112.206 -178.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . 0.518 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 81.65 -49.82 4.13 Favored Glycine 0 CA--C 1.524 0.611 0 C-N-CA 120.86 -0.686 . . . . 0.0 113.703 176.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -81.14 60.24 4.2 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.642 0.734 . . . . 0.0 110.275 -175.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.575 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -125.31 15.41 7.25 Favored Glycine 0 C--N 1.317 -0.499 0 CA-C-N 115.277 -0.874 . . . . 0.0 113.495 -179.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 67.1 mttm 70.44 79.47 0.18 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.547 0.689 . . . . 0.0 111.006 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.81 5.34 2.61 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.084 -177.504 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.479 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 3.7 mmp_? -54.61 -29.96 53.32 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.702 HD22 ' HB3' ' A' ' 133' ' ' TRP . 54.2 tp -61.18 -49.91 75.29 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.051 0.453 . . . . 0.0 110.463 177.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.615 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -61.23 -32.51 80.9 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.973 177.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -72.9 -36.81 67.38 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.594 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.6 mt -59.43 -37.23 77.55 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.57 -39.89 94.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.663 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . 0.615 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 52.9 mtt -64.73 -50.5 66.65 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.096 0.474 . . . . 0.0 110.275 177.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -60.42 -43.2 96.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.933 -178.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.518 HD11 ' HG3' ' A' ' 102' ' ' ARG . 44.8 tp -65.24 -40.84 94.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.462 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.443 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 51.6 ttp85 -56.69 -44.67 81.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.771 178.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . 0.495 ' O ' HG13 ' A' ' 158' ' ' ILE . 26.2 tt0 -71.78 -36.05 70.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.521 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 58.3 tp60 -61.66 -43.12 99.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.089 0.471 . . . . 0.0 110.292 176.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.702 HD13 ' HG3' ' A' ' 112' ' ' ARG . 93.1 mt -71.56 -29.83 65.18 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.55 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.433 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -63.42 -38.67 92.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.375 176.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 154' ' ' GLU . 75.1 mt -57.97 -43.26 84.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.56 176.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -61.44 -40.21 93.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.169 177.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -71.87 -23.25 61.48 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.749 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . 0.433 HD13 ' O ' ' A' ' 157' ' ' ALA . 5.0 mp -79.09 -40.54 30.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.191 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 . . . . . 0 C--N 1.325 -0.498 0 CA-C-O 121.089 0.471 . . . . 0.0 110.631 177.725 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 120.733 0.301 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -87.24 89.63 8.06 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.412 ' O ' HD13 ' A' ' 114' ' ' LEU . . . -92.43 -67.26 0.87 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.078 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.45 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -177.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 . . . . . 0 N--CA 1.456 -0.175 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.541 HG21 ' HD2' ' A' ' 120' ' ' PRO . 5.7 m -72.0 135.43 27.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.051 0.453 . . . . 0.0 110.636 175.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.59 14.06 1.8 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.83 -176.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 69.77 159.54 0.19 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.468 0.707 . . . . 0.0 111.053 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 51.03 29.72 4.8 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.382 0.611 . . . . 0.0 110.99 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.4 m -86.87 124.28 32.92 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.281 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 56.3 mt -110.66 115.48 49.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 169.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.2 mt -89.81 106.16 16.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.233 0.539 . . . . 0.0 110.286 -176.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.6 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 8.0 t-20 -106.65 126.86 52.82 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.591 -177.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.455 ' O ' ' HG3' ' A' ' 125' ' ' GLU . 27.2 p90 -128.78 -175.15 3.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.912 -178.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -142.19 104.72 4.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.11 -177.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 79.7 p 53.92 -166.33 0.08 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.622 0.769 . . . . 0.0 112.207 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.712 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 0.2 OUTLIER -81.71 -59.45 2.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.998 0.428 . . . . 0.0 110.232 178.66 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t 59.26 -96.34 0.06 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.444 175.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -144.24 -67.91 0.33 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.016 0.436 . . . . 0.0 111.732 -175.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -81.05 -79.4 0.16 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -165.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -88.92 -1.76 58.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.192 0.52 . . . . 0.0 111.532 -171.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.712 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -66.82 -0.63 9.1 Favored Glycine 0 CA--C 1.52 0.387 0 CA-C-N 116.019 -0.537 . . . . 0.0 114.231 -175.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -50.68 -32.1 18.31 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 117.332 0.566 . . . . 0.0 111.96 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -72.58 -12.54 61.1 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 98.6 p -77.3 126.89 31.65 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.843 177.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -51.15 -23.18 3.03 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -175.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.49 ' CZ ' ' HB2' ' A' ' 71' ' ' PRO . 54.1 t80 -62.4 -62.38 1.79 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 174.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.605 ' HA ' HG21 ' A' ' 22' ' ' THR . . . 32.26 -149.7 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.272 1.029 . . . . 0.0 113.753 -176.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -166.24 66.2 0.11 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.407 177.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.503 ' O ' ' HA ' ' A' ' 46' ' ' THR . 94.6 m95 -131.1 121.65 18.83 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.629 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.52 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 19.2 Cg_endo -59.4 126.55 21.08 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.854 2.37 . . . . 0.0 112.515 178.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.2 pt -119.86 157.74 22.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.155 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -119.42 95.34 4.75 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -177.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 t -131.09 142.31 43.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.174 -0.467 . . . . 0.0 109.971 -176.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.8 t70 67.14 17.06 10.35 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.817 0.818 . . . . 0.0 109.58 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 72.19 22.23 78.94 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.353 -174.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.3 tppt? -121.82 149.92 42.64 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -176.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.7 m -94.95 113.51 25.23 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.872 0.368 . . . . 0.0 110.156 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.52 ' O ' ' HA ' ' A' ' 36' ' ' PRO . 41.6 m95 -109.89 123.47 36.17 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.455 ' O ' ' HB ' ' A' ' 46' ' ' THR . 39.8 Cg_exo -58.94 -11.9 13.65 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 123.053 2.502 . . . . 0.0 113.794 -177.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 35' ' ' TRP . 8.9 t 177.57 170.11 0.63 Allowed 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 174.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -40.59 88.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -175.172 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -48.17 -42.57 30.08 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.195 0.31 . . . . 0.0 111.785 176.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -64.64 -41.86 95.85 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.181 -176.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -69.95 -43.52 71.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.215 0.531 . . . . 0.0 110.179 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.444 ' HA ' HG11 ' A' ' 96' ' ' VAL . 89.5 t80 -61.26 -42.36 98.5 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.497 178.301 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.667 ' HG3' HD13 ' A' ' 65' ' ' ILE . 5.3 tp-100 -68.83 -45.56 70.84 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.885 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.487 ' HB1' ' CG ' ' A' ' 62' ' ' ARG . . . -65.9 -47.43 74.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.762 -177.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -75.23 -13.69 60.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.569 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.526 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.9 ttmp? -59.23 -33.19 70.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.077 0.465 . . . . 0.0 110.532 171.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.546 ' CE1' ' HG3' ' A' ' 83' ' ' LYS . 56.9 m-85 -107.32 166.99 10.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.971 -176.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.741 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.5 pt? -115.08 11.37 16.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.043 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -97.15 123.22 40.85 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.225 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.15 -40.13 86.64 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.101 -173.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -60.21 -53.77 53.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.923 0.392 . . . . 0.0 110.348 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 65' ' ' ILE . 3.1 t80 -66.44 -32.81 74.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.592 -177.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.487 ' CG ' ' HB1' ' A' ' 53' ' ' ALA . 44.4 ttm-85 -60.6 -49.41 77.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.019 0.437 . . . . 0.0 110.313 178.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -78.4 -15.15 58.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.109 0.48 . . . . 0.0 110.354 -178.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -74.66 -40.31 61.51 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.667 HD13 ' HG3' ' A' ' 52' ' ' GLN . 72.0 mt -70.39 -25.81 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.124 174.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.07 -22.06 53.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.854 174.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 73.4 ttt-85 -80.99 -29.97 35.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.958 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.511 HG21 ' HB ' ' A' ' 73' ' ' VAL . 14.9 p -75.8 126.61 36.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.235 0.54 . . . . 0.0 110.736 -179.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m -74.44 -41.75 60.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.506 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.466 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 30.2 t -69.09 130.05 91.63 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.069 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.49 ' HB2' ' CZ ' ' A' ' 32' ' ' PHE . 7.2 Cg_exo -73.45 -26.07 14.6 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.592 2.194 . . . . 0.0 111.322 174.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.5 tpt -70.44 -43.27 70.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.321 -177.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.511 ' HB ' HG21 ' A' ' 68' ' ' VAL . 59.8 t -63.84 -34.09 66.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.048 177.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.14 -49.53 74.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.472 177.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.542 ' HA ' HE21 ' A' ' 52' ' ' GLN . . . -60.16 -37.42 80.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.551 177.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -62.08 -33.93 75.34 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.758 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.522 ' SD ' HG12 ' A' ' 65' ' ' ILE . 56.1 mtt -65.72 -50.69 63.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.131 0.491 . . . . 0.0 111.473 -179.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.608 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -94.3 4.42 70.32 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.29 -0.957 . . . . 0.0 113.568 -174.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 5.3 tpp180 -71.24 -25.13 62.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.908 0.354 . . . . 0.0 111.211 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -99.37 131.97 45.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.152 0.501 . . . . 0.0 109.701 177.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.5 mtm180 -101.35 29.88 4.52 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.397 -172.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.4 p -82.7 19.73 1.27 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.574 0.702 . . . . 0.0 109.935 174.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.546 ' HG3' ' CE1' ' A' ' 56' ' ' PHE . 41.1 mmtm -89.22 169.72 12.36 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.703 178.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 16.8 Cg_endo -60.14 -29.13 88.42 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.332 2.021 . . . . 0.0 111.537 170.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.7 mt 67.72 -174.06 0.19 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.129 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.467 ' HB3' ' HB2' ' A' ' 89' ' ' TRP . 57.0 ttt-85 -134.18 142.27 47.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.811 -176.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -64.37 -68.41 0.36 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.799 -175.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -81.96 25.94 0.54 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.411 -174.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.489 ' CZ2' ' HE3' ' A' ' 55' ' ' LYS . 58.5 t-105 -61.0 -33.11 72.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.117 0.484 . . . . 0.0 110.104 177.294 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.415 ' O ' ' HE3' ' A' ' 93' ' ' LYS . 40.3 tt0 -55.92 -35.78 66.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.071 -178.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.1 p -99.93 -8.52 23.88 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -173.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.487 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.7 m -108.74 1.81 9.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -175.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.487 ' HB2' ' HZ2' ' A' ' 93' ' ' LYS . 10.0 mtmp? -54.92 -57.69 10.63 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.593 0.711 . . . . 0.0 110.49 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.543 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 1.9 pm0 -78.14 -14.94 59.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.134 -178.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.551 ' O ' ' HD3' ' A' ' 99' ' ' LYS . 34.0 tt0 -73.11 -52.37 14.5 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 176.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.444 HG11 ' HA ' ' A' ' 51' ' ' PHE . 96.8 t -58.44 -41.41 81.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.996 177.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 mmt -60.46 -39.0 86.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.281 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 38.1 ttm-85 -61.56 -38.45 87.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.524 0.202 . . . . 0.0 111.105 -178.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.551 ' HD3' ' O ' ' A' ' 95' ' ' GLN . 0.3 OUTLIER -71.03 -48.17 54.46 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.916 0.388 . . . . 0.0 110.805 176.23 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.2 -42.86 99.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.466 -177.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.6 -38.56 84.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.182 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 52.1 ttt180 -63.3 -48.17 79.2 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.06 178.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 107' ' ' GLN . . . -59.02 -38.01 78.26 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.981 0.419 . . . . 0.0 110.408 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.436 ' HZ3' HD13 ' A' ' 111' ' ' LEU . 60.4 tttm -62.11 -52.37 64.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.323 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.517 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 68.5 m-85 -81.96 -41.66 20.49 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -174.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -75.42 -39.59 58.76 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 121.969 -0.457 . . . . 0.0 111.197 -173.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.414 ' HB3' ' O ' ' A' ' 103' ' ' ALA . 29.4 tt0 -74.63 -31.19 61.91 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.796 0.331 . . . . 0.0 110.662 -178.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -100.21 97.55 8.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.31 66.04 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -171.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.472 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.7 pm0 -68.14 -32.45 72.74 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.038 -178.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.436 HD13 ' HZ3' ' A' ' 104' ' ' LYS . 42.4 mt -74.34 -37.15 63.61 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.584 ' HG3' HD13 ' A' ' 156' ' ' LEU . 24.5 ttm180 -58.23 -50.26 74.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.121 177.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.95 -39.88 95.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.724 -179.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.412 HD13 ' O ' ' A' ' 5' ' ' ALA . 58.6 tp -59.46 -48.83 80.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.583 177.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 44.1 tp -62.93 -39.61 95.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.993 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.423 HD21 ' HB2' ' A' ' 156' ' ' LEU . 80.5 mt -76.61 -15.03 59.94 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -82.97 -18.18 40.84 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.71 0.291 . . . . 0.0 111.159 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 66.2 p -72.44 -35.01 68.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.031 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.66 138.47 16.87 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.793 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.541 ' HD2' HG21 ' A' ' 11' ' ' VAL . 43.1 Cg_endo -95.72 29.16 15.96 Favored 'Cis proline' 0 CA--C 1.533 0.458 0 C-N-CA 124.147 -1.189 . . . . 0.0 113.657 1.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.19 153.32 43.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.88 0.372 . . . . 0.0 111.354 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -92.29 134.81 34.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.261 -177.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 40.1 mt -98.5 109.45 22.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.88 0.372 . . . . 0.0 110.708 -177.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.6 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 91.2 t -139.41 122.72 18.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.447 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 19' ' ' PHE . 87.6 tt0 -101.31 118.19 36.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.088 0.47 . . . . 0.0 110.77 176.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' HIS . . . . . 0.79 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 57.4 t60 -89.92 81.76 6.25 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 173.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 14.5 t -120.86 143.52 48.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.304 -178.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -118.56 9.03 12.14 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.403 0.62 . . . . 0.0 109.808 175.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -62.24 -33.33 74.38 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.468 176.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -155.52 119.0 4.41 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.472 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -80.73 85.51 6.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.225 0.536 . . . . 0.0 110.787 -175.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.666 ' HA ' ' O ' ' A' ' 141' ' ' GLY . 40.2 t80 179.01 153.03 0.38 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.559 -1.2 . . . . 0.0 107.911 173.144 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.645 ' O ' ' HB3' ' A' ' 145' ' ' LEU . 84.1 m95 78.73 -19.19 0.46 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.557 0.743 . . . . 0.0 111.537 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' A' ' 143' ' ' ASN . . . -138.04 -152.82 6.12 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.373 -174.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.79 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 20.4 t70 -67.46 -24.86 65.65 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.156 0.503 . . . . 0.0 110.802 178.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' GLY . . . . . 0.536 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 72.51 8.32 71.09 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.506 178.357 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 88.17 -10.66 70.13 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.408 -0.425 . . . . 0.0 113.103 178.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . 0.605 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 24.9 p80 -160.63 30.12 0.16 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.928 0.364 . . . . 0.0 111.625 -173.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 84.35 -51.37 4.55 Favored Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.813 -0.708 . . . . 0.0 113.191 177.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.605 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 53.1 mttp -75.49 55.4 0.81 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.073 0.463 . . . . 0.0 111.676 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.666 ' O ' ' HA ' ' A' ' 132' ' ' TYR . . . -123.7 -4.84 7.91 Favored Glycine 0 C--O 1.223 -0.576 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.0 176.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.405 ' C ' ' H ' ' A' ' 144' ' ' ARG . 2.9 mptp? 61.4 84.2 0.14 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.962 0.381 . . . . 0.0 111.722 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.437 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 8.0 t30 -68.08 5.73 0.87 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.412 1.085 . . . . 0.0 111.597 -178.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.405 ' H ' ' C ' ' A' ' 142' ' ' LYS . 14.0 tpt180 -33.06 -31.05 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.542 1.137 . . . . 0.0 113.276 176.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.645 ' HB3' ' O ' ' A' ' 133' ' ' TRP . 25.5 tp -68.23 -49.23 62.12 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 117.944 0.338 . . . . 0.0 110.957 -179.268 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -61.47 -32.54 81.51 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.251 -0.74 . . . . 0.0 111.251 177.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -69.01 -43.25 75.17 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 175.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.5 -48.79 76.44 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.439 175.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.82 -42.08 88.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.892 178.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 73.1 mtm -69.04 -37.46 78.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.331 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -60.57 -51.63 68.59 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.705 0.288 . . . . 0.0 110.253 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 64.3 tp -60.11 -43.07 95.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.416 178.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.441 HH21 ' HA ' ' A' ' 120' ' ' PRO . 2.4 ttt-85 -51.85 -56.95 10.92 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.676 177.352 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . 0.472 ' O ' HG13 ' A' ' 158' ' ' ILE . 35.8 mt-10 -72.86 -22.98 60.69 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.213 -178.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -68.57 -39.14 81.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.222 174.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.584 HD13 ' HG3' ' A' ' 112' ' ' ARG . 96.0 mt -67.93 -31.25 70.87 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.108 0.48 . . . . 0.0 109.892 179.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.575 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -67.38 -46.08 74.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.34 175.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 154' ' ' GLU . 85.2 mt -65.72 -34.39 70.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -59.67 -34.35 72.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.303 0.573 . . . . 0.0 109.943 175.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -79.14 -18.81 52.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.667 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' LEU . . . . . 0.575 HD13 ' O ' ' A' ' 157' ' ' ALA . 6.1 mp -78.43 -25.06 45.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.114 0.483 . . . . 0.0 110.619 176.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.324 178.327 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.5 tmm? . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -96.9 115.2 0.13 Allowed 'Trans proline' 0 N--CA 1.447 -1.229 0 C-N-CA 123.333 2.689 . . . . 0.0 112.661 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.4 t -76.37 84.77 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 175.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -131.12 153.83 48.96 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.657 -176.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.51 136.15 42.2 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 163.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.586 ' HB3' ' HA ' ' A' ' 9' ' ' GLN . 73.7 mm-40 66.97 69.41 0.4 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.656 0.597 . . . . 0.0 110.538 -173.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -58.11 -53.48 57.79 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 174.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 66.8 mt -100.8 107.53 21.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 164.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.586 ' HA ' ' HB3' ' A' ' 6' ' ' GLN . 76.8 mt-30 -61.25 94.12 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 O-C-N 123.693 0.621 . . . . 0.0 110.677 -175.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.6 t60 60.64 98.7 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.123 0 O-C-N 123.968 0.792 . . . . 0.0 110.432 -174.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -61.53 168.85 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 111.09 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.456 ' O ' ' HB2' ' A' ' 13' ' ' GLN . 4.5 mtt -64.09 -85.5 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.215 -174.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' MET . 8.8 tt0 169.89 120.49 0.01 OUTLIER 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.759 -177.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 65.03 26.16 12.62 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.24 0.543 . . . . 0.0 110.509 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.47 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 29.3 m -76.87 110.97 11.92 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.299 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.9 mm -77.35 108.36 10.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.9 mt -95.82 99.32 9.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.764 -177.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.75 106.67 18.67 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 173.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -117.47 132.8 56.49 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.036 -175.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -150.48 100.36 2.86 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.773 167.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.409 ' HB3' ' OD2' ' A' ' 24' ' ' ASP . 6.9 m 177.89 88.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 O-C-N 124.065 0.853 . . . . 0.0 109.458 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.701 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 1.3 m -79.87 2.63 22.55 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.994 0.426 . . . . 0.0 111.473 -174.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.1 m -91.42 -8.32 48.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.706 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.409 ' OD2' ' HB3' ' A' ' 21' ' ' SER . 4.1 p30 -131.18 -165.5 1.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.305 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -65.7 -26.46 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.364 -172.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -80.38 -2.49 45.75 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.92 0.39 . . . . 0.0 111.034 177.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.701 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -83.26 -16.84 68.19 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.728 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -68.25 -26.64 65.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.071 0.462 . . . . 0.0 110.898 -179.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -69.28 -26.17 64.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.31 178.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.3 m -76.08 126.76 31.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 171.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -60.46 -20.71 60.85 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -76.51 4.71 8.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.116 0.484 . . . . 0.0 111.225 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -66.75 131.46 46.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.749 0.309 . . . . 0.0 110.678 176.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.499 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -80.93 58.83 3.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.198 0.523 . . . . 0.0 111.681 -175.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -102.34 117.64 60.66 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.822 174.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.6 125.14 17.8 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.956 2.438 . . . . 0.0 112.556 -176.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.757 HG22 ' HA ' ' A' ' 104' ' ' LYS . 29.5 pt -114.4 139.34 40.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.299 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -102.54 105.09 15.55 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.441 HG22 ' CB ' ' A' ' 103' ' ' ALA . 4.0 t -128.57 123.12 58.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.263 -173.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 59.21 27.21 16.16 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.191 174.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.61 -5.62 57.01 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.563 -0.827 . . . . 0.0 113.433 175.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.519 ' HD3' ' HD2' ' A' ' 66' ' ' ARG . 60.9 mttm -124.05 156.9 35.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 117.596 0.698 . . . . 0.0 111.373 -178.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.1 m -100.54 117.04 33.88 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.266 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.489 ' HB2' HG13 ' A' ' 37' ' ' ILE . 41.1 m95 -105.86 133.92 19.98 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.431 -179.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 43.8 Cg_exo -58.43 -41.27 67.17 Favored 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 122.66 2.24 . . . . 0.0 112.752 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.499 HG22 ' HA ' ' A' ' 34' ' ' ALA . 77.9 p -148.24 172.14 14.82 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -33.49 75.18 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -177.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.592 ' H ' ' CD ' ' A' ' 48' ' ' GLU . 3.6 mp0 -61.3 -28.55 69.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.947 0.403 . . . . 0.0 110.904 -177.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.419 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 57.1 m80 -65.91 -48.01 72.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.401 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -72.75 -35.99 67.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.335 0.588 . . . . 0.0 109.758 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -59.58 -49.1 79.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.028 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.434 ' HA ' ' CB ' ' A' ' 55' ' ' LYS . 37.2 mt-30 -85.97 -13.31 48.02 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.682 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.479 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -69.43 -30.43 68.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.26 0.552 . . . . 0.0 109.961 173.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -90.8 -21.76 21.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.649 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.434 ' CB ' ' HA ' ' A' ' 52' ' ' GLN . 83.0 tttt -58.12 -53.31 59.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.2 0.524 . . . . 0.0 110.606 176.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -91.56 142.05 28.05 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.75 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.759 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.4 pt? -98.5 10.13 41.62 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 173.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.4 ' HB2' ' HB3' ' A' ' 61' ' ' TYR . 33.7 m-20 -67.51 112.34 4.63 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.762 174.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -50.98 -61.82 1.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.022 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -77.16 -18.27 57.96 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.866 -171.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.543 ' O ' HG13 ' A' ' 65' ' ' ILE . 3.9 t80 -80.58 -35.64 33.95 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.479 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 33.5 ttm180 -59.21 -44.44 92.26 Favored 'General case' 0 CA--C 1.521 -0.144 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 173.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.42 -39.72 76.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.495 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.441 ' CD ' HH21 ' A' ' 67' ' ' ARG . 7.8 tp10 -63.0 -49.24 75.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.916 0.389 . . . . 0.0 110.682 177.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.543 HG13 ' O ' ' A' ' 61' ' ' TYR . 3.5 mt -70.19 -22.78 24.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.185 0.517 . . . . 0.0 110.877 -177.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.519 ' HD2' ' HD3' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -78.46 -29.27 46.77 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.211 176.891 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.441 HH21 ' CD ' ' A' ' 64' ' ' GLU . 56.5 ttp180 -86.02 -35.44 20.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.638 -175.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.4 p -65.43 117.4 6.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.474 0.654 . . . . 0.0 111.22 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.2 m -77.14 -33.72 56.66 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.593 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.3 m -66.24 126.55 92.2 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.335 -178.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.419 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 54.4 Cg_endo -71.86 -40.64 2.56 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.828 2.352 . . . . 0.0 113.281 -179.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 87.0 mtp -70.29 -29.8 66.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.745 0.307 . . . . 0.0 110.74 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.519 ' O ' ' HG3' ' A' ' 77' ' ' MET . 99.6 t -66.74 -39.51 83.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.558 178.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.36 -39.36 90.33 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 120.92 0.391 . . . . 0.0 110.369 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.64 -38.27 80.34 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.711 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -65.97 -57.36 8.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.954 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -83.26 -13.04 56.08 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.319 -0.553 . . . . 0.0 111.159 -176.58 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.34 -10.33 60.87 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.644 -0.788 . . . . 0.0 111.607 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.72 -40.46 66.09 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 122.742 0.417 . . . . 0.0 111.647 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.456 ' OD2' ' HG3' ' A' ' 83' ' ' LYS . 30.3 t70 -59.73 137.47 58.03 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.015 -170.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 87.1 mtm-85 -116.96 18.54 14.67 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.059 176.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.4 m -90.91 -28.96 17.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.663 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.456 ' HG3' ' OD2' ' A' ' 80' ' ' ASP . 6.1 mtpm? -63.31 156.69 68.26 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.257 176.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.05 113.62 1.66 Allowed 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.43 2.087 . . . . 0.0 111.786 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 67.0 mt -101.04 163.75 12.14 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.485 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.443 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 23.6 mtp180 -67.26 139.27 57.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.842 0.353 . . . . 0.0 110.446 176.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 43.2 mtpt -60.64 -28.41 68.54 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.495 0.664 . . . . 0.0 110.604 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -104.07 12.96 33.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.413 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.493 ' HA ' HG22 ' A' ' 92' ' ' VAL . 50.3 t-105 -59.98 -33.65 72.24 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.534 -176.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.66 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 18.3 mm-40 -65.65 -24.32 67.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.398 -179.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.3 t -99.68 -44.78 5.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.299 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.7 m -73.96 3.01 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -170.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.66 ' NZ ' ' HA ' ' A' ' 90' ' ' GLU . 56.7 mttp -56.79 -42.35 79.32 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 175.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.498 ' O ' ' HB2' ' A' ' 98' ' ' ARG . 52.1 mt-10 -61.13 -39.5 90.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.833 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -69.19 -50.88 43.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.368 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 59.6 t -63.78 -49.37 82.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.776 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.498 ' SD ' HD13 ' A' ' 145' ' ' LEU . 50.7 ttm -66.2 -36.06 82.08 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.335 -177.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' A' ' 94' ' ' GLU . 20.3 ttt180 -61.31 -43.16 99.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.832 0.349 . . . . 0.0 110.664 -179.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -70.51 -35.34 73.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.572 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.88 88.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.732 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.468 HD11 HD12 ' A' ' 145' ' ' LEU . 94.0 mt -64.46 -40.3 95.44 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.53 176.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.497 ' O ' ' HB2' ' A' ' 106' ' ' GLU . 34.2 ttm180 -54.17 -54.46 39.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.1 175.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.441 ' CB ' HG22 ' A' ' 39' ' ' VAL . . . -62.05 -34.43 76.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.457 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.757 ' HA ' HG22 ' A' ' 37' ' ' ILE . 64.4 tttm -63.96 -56.1 17.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.249 -178.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.497 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 71.2 m-85 -78.38 -28.0 46.96 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -175.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -79.02 -40.58 31.04 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.09 -177.464 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -69.61 -14.67 62.95 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.05 0.452 . . . . 0.0 110.884 -176.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -124.98 105.97 9.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.359 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -56.67 -31.43 64.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.96 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.05 -47.41 81.03 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.964 177.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 36.0 mt -74.49 -39.85 62.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.763 -175.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.589 ' HG3' HD13 ' A' ' 156' ' ' LEU . 61.9 ttt180 -59.12 -48.45 81.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.451 178.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.8 -35.14 80.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.553 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 62.2 tp -64.61 -37.15 86.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.61 176.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.471 ' HG ' ' HB2' ' A' ' 153' ' ' ARG . 16.5 tp -64.02 -50.52 68.14 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.099 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.506 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 4.6 mp -67.44 -19.71 65.4 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.82 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -67.67 -30.15 69.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.511 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.445 ' HB ' HD21 ' A' ' 123' ' ' LEU . 70.0 p -81.3 -0.46 41.06 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 120.758 0.313 . . . . 0.0 111.683 -177.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.541 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -86.33 139.94 34.17 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 170.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.433 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 73.7 Cg_endo -99.11 74.67 0.14 OUTLIER 'Cis proline' 0 N--CA 1.454 -0.799 0 C-N-CA 124.468 -1.055 . . . . 0.0 113.291 -0.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.47 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -111.0 176.4 5.04 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -120.83 120.53 35.83 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.996 0.426 . . . . 0.0 110.272 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.445 HD21 ' HB ' ' A' ' 118' ' ' THR . 9.1 mt -86.32 125.85 33.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.787 -173.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.2 t -130.83 116.85 35.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.845 0.355 . . . . 0.0 110.925 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -79.99 130.48 35.31 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 175.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.633 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 10.6 t60 -125.64 77.47 1.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.188 0.518 . . . . 0.0 109.613 -173.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 5.0 t -87.2 114.23 23.63 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.543 0.687 . . . . 0.0 109.319 175.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.711 ' OE2' ' HA3' ' A' ' 137' ' ' GLY . 5.6 tp10 -82.17 41.32 0.67 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.616 0.722 . . . . 0.0 109.378 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -143.06 -75.79 0.26 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.375 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -118.42 95.35 4.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.068 -174.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.35 86.08 2.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.165 -177.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.448 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 28.7 t80 -151.08 122.06 7.65 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.606 ' O ' ' HB3' ' A' ' 145' ' ' LEU . 71.3 m95 74.73 -10.34 1.2 Allowed 'General case' 0 N--CA 1.474 0.737 0 O-C-N 124.016 0.823 . . . . 0.0 110.585 -171.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.569 ' O ' ' HA3' ' A' ' 141' ' ' GLY . . . -137.79 136.99 8.54 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 108.196 -1.962 . . . . 0.0 108.196 176.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.561 ' HB2' ' HB2' ' A' ' 143' ' ' ASN . 1.4 t70 -68.82 1.77 3.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.697 0.749 . . . . 0.0 112.109 -166.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 68.85 -164.53 49.32 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.933 175.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.711 ' HA3' ' OE2' ' A' ' 128' ' ' GLU . . . -89.98 -17.02 55.13 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.924 178.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -99.63 -16.92 18.05 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 89.08 62.07 1.38 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.118 -1.039 . . . . 0.0 112.468 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 56.4 tttm 176.84 65.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 176.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.569 ' HA3' ' O ' ' A' ' 134' ' ' GLY . . . -124.67 4.62 8.61 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.176 -1.012 . . . . 0.0 113.441 -173.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.438 ' C ' ' H ' ' A' ' 144' ' ' ARG . 55.0 mttp 64.19 53.71 1.73 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.122 0.486 . . . . 0.0 109.895 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.561 ' HB2' ' HB2' ' A' ' 135' ' ' ASP . 7.4 t30 -57.15 5.1 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.368 1.467 . . . . 0.0 113.791 -177.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.533 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 57.9 mtm180 -51.84 -13.28 0.26 Allowed 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.606 ' HB3' ' O ' ' A' ' 133' ' ' TRP . 25.4 tp -60.57 -49.84 75.94 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 171.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.653 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -62.92 -33.03 85.98 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.555 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -68.82 -41.21 78.93 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 121.165 -0.214 . . . . 0.0 110.638 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 88.7 mt -58.05 -37.13 73.82 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.83 -38.07 89.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.914 175.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.653 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 38.5 mtt -66.35 -50.28 64.08 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.183 0.516 . . . . 0.0 110.189 178.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 23.0 tt0 -69.38 -35.95 76.31 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.608 -176.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 102' ' ' ARG . 50.9 tp -62.07 -43.92 97.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.041 0.448 . . . . 0.0 109.859 174.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.541 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 47.5 ttp85 -55.51 -41.54 73.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.969 176.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.503 ' O ' HG13 ' A' ' 158' ' ' ILE . 31.6 tt0 -68.36 -34.71 76.57 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.684 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' ' 151' ' ' GLU . 15.3 mt-30 -65.35 -41.85 93.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.068 0.461 . . . . 0.0 109.858 176.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.589 HD13 ' HG3' ' A' ' 112' ' ' ARG . 94.3 mt -67.27 -28.88 68.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.086 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -69.44 -40.95 76.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.453 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 154' ' ' GLU . 76.2 mt -60.63 -46.06 96.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.669 0.271 . . . . 0.0 110.474 178.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . 0.49 ' CD ' HH22 ' A' ' 112' ' ' ARG . 0.2 OUTLIER -61.3 -38.45 86.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.07 0.462 . . . . 0.0 110.088 177.381 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -70.33 -33.31 71.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.477 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 4.6 mp -68.63 -10.62 57.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.132 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -83.7 10.26 9.74 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.426 174.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -53.81 106.7 0.2 Allowed 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 121.692 0.758 . . . . 0.0 111.952 176.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -154.8 86.36 1.12 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 176.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.01 143.47 29.47 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.072 -174.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -79.15 75.83 5.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.117 -176.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 33.9 m-70 -160.08 -39.65 0.05 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.218 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 . . . . . 0 C--O 1.244 0.78 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.083 179.775 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 ptt? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -84.58 105.57 1.03 Allowed 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 122.785 2.324 . . . . 0.0 112.85 -177.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.779 HG22 ' H ' ' A' ' 5' ' ' ALA . 2.5 p -137.95 -65.93 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.926 177.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.68 ' H ' HG13 ' A' ' 3' ' ' VAL . 7.2 tpp85 56.84 25.73 10.73 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.74 0.781 . . . . 0.0 111.586 178.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.779 ' H ' HG22 ' A' ' 3' ' ' VAL . . . -69.32 127.87 34.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 173.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -66.2 -41.81 89.66 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.946 -176.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 64.82 171.1 0.2 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.505 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.416 HD11 ' HA ' ' A' ' 118' ' ' THR . 25.8 pt -135.85 150.68 28.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.762 175.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -72.91 -38.75 66.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.111 0.481 . . . . 0.0 110.169 177.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.8 p-80 -165.34 171.55 13.34 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.89 179.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.728 HG21 ' HD2' ' A' ' 120' ' ' PRO . 34.1 m -93.74 175.19 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 174.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 51.4 mtm -108.95 37.22 2.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.312 -178.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.403 ' H ' HG23 ' A' ' 11' ' ' VAL . 52.2 tt0 63.83 102.56 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.952 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.3 t70 49.95 79.84 0.08 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.528 -175.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.8 m -103.66 127.41 51.1 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.713 -178.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 48.5 mt -96.67 107.13 19.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 CA-C-O 121.446 0.641 . . . . 0.0 110.074 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -89.89 96.96 6.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.24 -176.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.555 HD22 ' HB ' ' A' ' 124' ' ' VAL . 12.7 m120 -83.51 101.34 11.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.362 174.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.447 ' O ' ' HA ' ' A' ' 125' ' ' GLU . 52.5 p90 -116.19 148.93 39.89 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.781 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.44 ' HB2' ' HB3' ' A' ' 126' ' ' HIS . 34.9 t80 -150.23 150.3 31.38 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.388 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 96.1 p 62.48 159.52 0.07 Allowed 'General case' 0 C--O 1.231 0.113 0 O-C-N 124.867 1.354 . . . . 0.0 111.661 177.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.498 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 7.8 p -83.14 -65.99 0.94 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.528 175.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.1 t 61.41 -78.88 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.205 0 O-C-N 124.135 0.897 . . . . 0.0 111.625 176.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -105.9 -169.08 1.53 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.901 0.381 . . . . 0.0 110.117 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -66.02 -31.93 73.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.749 -174.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -75.99 -1.59 26.44 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.309 0.576 . . . . 0.0 111.187 -175.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.498 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -68.53 -0.32 16.93 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.109 174.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -52.36 -32.47 38.55 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.602 0.761 . . . . 0.0 112.642 -177.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -60.1 -36.49 77.53 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.7 t -59.97 148.86 33.74 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.133 0.492 . . . . 0.0 111.04 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -74.5 -14.64 60.84 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.096 0.474 . . . . 0.0 109.928 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -96.84 7.9 45.57 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.31 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.475 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -70.69 136.06 48.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.715 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -83.12 64.6 7.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.608 0.718 . . . . 0.0 110.939 -174.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.414 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 70.4 m95 -108.86 120.97 44.46 Favored Pre-proline 0 C--N 1.314 -0.957 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.048 172.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 34.5 Cg_exo -60.49 133.45 48.97 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.985 2.457 . . . . 0.0 112.518 -177.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.482 HD13 ' HA ' ' A' ' 47' ' ' SER . 39.0 pt -118.81 147.91 22.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.967 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -109.04 98.62 8.06 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.414 ' CG1' ' HE2' ' A' ' 99' ' ' LYS . 21.2 t -122.02 120.37 61.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.913 -174.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 61.57 27.8 17.19 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.593 0.558 . . . . 0.0 110.629 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.39 0.57 90.12 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 121.034 -0.603 . . . . 0.0 112.462 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -104.63 144.4 31.76 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -177.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.1 m -105.29 109.07 20.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.924 0.392 . . . . 0.0 110.674 -175.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.41 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 62.4 m95 -102.05 143.84 27.41 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.713 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 32.4 Cg_exo -59.24 -30.48 93.07 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.939 2.426 . . . . 0.0 112.248 179.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.748 HG23 ' OE1' ' A' ' 48' ' ' GLU . 2.3 t -170.76 -179.93 3.01 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.882 177.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.482 ' HA ' HD13 ' A' ' 37' ' ' ILE . 20.3 m -66.62 -39.62 88.41 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 113.369 0.878 . . . . 0.0 113.369 -166.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.748 ' OE1' HG23 ' A' ' 46' ' ' THR . 0.6 OUTLIER -63.15 -33.99 76.65 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.498 -171.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -56.01 -42.99 77.3 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.609 0.242 . . . . 0.0 111.072 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -71.46 -39.63 70.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.99 0.424 . . . . 0.0 110.24 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -60.63 -38.37 84.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.151 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.1 mm100 -72.87 -46.47 52.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.424 177.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.657 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -61.4 -42.18 98.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.705 -179.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -84.8 -13.66 50.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.764 -176.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.591 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.8 ttmp? -64.35 -53.14 53.31 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.86 0.362 . . . . 0.0 110.612 173.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.444 ' HE1' ' HB2' ' A' ' 83' ' ' LYS . 92.9 m-85 -80.66 160.22 25.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.12 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.494 HD11 ' HB3' ' A' ' 86' ' ' ARG . 5.5 mp -98.89 -28.84 13.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.645 177.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -58.85 120.57 9.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.06 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -68.72 -37.45 79.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -61.27 -42.74 99.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.417 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.423 ' O ' HG13 ' A' ' 65' ' ' ILE . 0.2 OUTLIER -74.14 -37.28 64.09 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.68 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.657 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.5 ttm180 -62.58 -41.56 99.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.397 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.522 ' HG2' ' NH1' ' A' ' 67' ' ' ARG . 16.5 tt0 -71.04 -26.93 63.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.025 178.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -68.09 -40.46 82.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.851 175.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.516 HG12 ' SD ' ' A' ' 77' ' ' MET . 56.6 mt -71.89 -18.52 19.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.283 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -75.38 -24.65 57.27 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.522 ' NH1' ' HG2' ' A' ' 63' ' ' GLU . 35.8 mmt-85 -73.37 -36.08 66.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.999 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.467 HG21 ' HB ' ' A' ' 73' ' ' VAL . 14.9 p -75.39 125.39 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.638 0.733 . . . . 0.0 112.038 -171.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.2 p -91.4 -38.78 12.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.392 176.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 20.0 m -72.57 121.04 83.84 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.513 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -52.52 -46.29 34.23 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.658 2.906 . . . . 0.0 113.519 179.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 85.1 mtp -63.81 -31.36 72.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.322 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.467 ' HB ' HG21 ' A' ' 68' ' ' VAL . 43.2 t -75.98 -32.29 23.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.808 0.337 . . . . 0.0 110.244 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.62 99.51 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.265 0.555 . . . . 0.0 110.462 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.23 -39.51 86.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.09 175.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -34.62 72.03 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.899 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.516 ' SD ' HG12 ' A' ' 65' ' ' ILE . 64.2 mtt -64.73 -55.04 22.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.061 0.458 . . . . 0.0 110.653 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.22 11.59 60.37 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.047 -0.597 . . . . 0.0 113.007 -176.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.54 -15.73 63.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.074 0.464 . . . . 0.0 110.372 174.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -107.18 114.03 27.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.439 177.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.638 ' HB2' HD11 ' A' ' 85' ' ' LEU . 26.1 ptt180 -101.16 24.93 8.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.783 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.4 m -81.08 -9.96 59.74 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.662 0.744 . . . . 0.0 109.223 174.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.444 ' HB2' ' HE1' ' A' ' 56' ' ' PHE . 46.8 mmtm -80.59 166.29 40.5 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.864 177.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -56.31 108.36 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.466 2.111 . . . . 0.0 113.126 -177.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.638 HD11 ' HB2' ' A' ' 81' ' ' ARG . 92.7 mt -91.8 148.85 21.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.824 175.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.494 ' HB3' HD11 ' A' ' 57' ' ' LEU . 11.6 ptp180 -84.26 150.01 25.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.04 0.448 . . . . 0.0 111.519 -175.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -75.27 -25.45 58.02 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.997 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -90.92 9.94 28.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.835 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.447 ' HB2' ' HG3' ' A' ' 86' ' ' ARG . 58.0 t-105 -56.27 -47.6 78.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.756 -174.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.4 -16.52 64.15 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -177.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.4 m -99.6 -30.45 12.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.89 0.376 . . . . 0.0 111.285 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 29.7 m -93.0 -0.08 10.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.668 0.27 . . . . 0.0 110.7 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -55.39 -57.95 9.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.195 0.522 . . . . 0.0 110.554 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -64.63 -40.62 95.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.984 177.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.49 -53.65 48.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.566 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 45.1 t -60.18 -49.27 84.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.072 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.1 tpt -65.94 -38.91 89.83 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.908 -174.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.511 ' HD3' HD22 ' A' ' 148' ' ' LEU . 31.8 mtm180 -73.5 -22.63 60.09 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.444 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.414 ' HE2' ' CG1' ' A' ' 39' ' ' VAL . 86.9 tttt -72.97 -38.37 66.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.015 0.436 . . . . 0.0 109.858 176.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.77 -42.38 67.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.473 176.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.459 HD22 HD21 ' A' ' 149' ' ' LEU . 61.7 mt -63.13 -42.98 99.6 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.008 177.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 102' ' ' ARG . 40.7 ttm180 -52.35 -53.0 50.3 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.768 175.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.422 ' CB ' ' HB ' ' A' ' 37' ' ' ILE . . . -55.36 -43.62 75.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.002 -176.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -63.0 -52.14 64.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.685 0.279 . . . . 0.0 111.013 -176.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -77.37 -28.59 52.93 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -79.64 -46.21 17.62 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 122.248 -0.282 . . . . 0.0 111.15 -175.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -66.58 -38.95 88.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.88 0.371 . . . . 0.0 110.767 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -101.96 100.27 10.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.437 178.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.406 ' HA ' ' HB2' ' A' ' 112' ' ' ARG . . . -61.92 -22.64 65.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.106 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.8 mp0 -56.48 -49.58 74.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.909 175.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 51.3 mt -74.71 -33.93 62.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.953 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 109' ' ' ALA . 15.4 ttt180 -54.35 -51.14 65.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.274 177.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.7 -36.61 80.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.873 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.3 tp -65.23 -41.01 94.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.579 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.739 ' HG ' ' HB2' ' A' ' 153' ' ' ARG . 47.2 tp -63.78 -33.65 76.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.539 177.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.3 mt -81.19 -14.98 57.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.148 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.91 -30.51 21.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.182 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.416 ' HA ' HD11 ' A' ' 8' ' ' ILE . 18.1 p -72.36 -25.92 61.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.152 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.417 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -40.67 132.62 1.75 Allowed Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.147 173.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.728 ' HD2' HG21 ' A' ' 11' ' ' VAL . 28.2 Cg_endo -101.15 31.27 10.14 Favored 'Cis proline' 0 N--CA 1.459 -0.528 0 C-N-CA 124.702 -0.957 . . . . 0.0 112.807 -1.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -60.01 141.84 54.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.902 0.382 . . . . 0.0 111.658 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.512 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 17.3 ttpt -84.62 113.89 21.59 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.98 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 41.5 mt -81.47 116.88 21.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.776 -175.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.555 ' HB ' HD22 ' A' ' 18' ' ' ASN . 89.1 t -128.88 116.72 42.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.732 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.447 ' HA ' ' O ' ' A' ' 19' ' ' PHE . 37.0 tt0 -88.13 128.39 35.43 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.496 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 8.0 t60 -97.05 77.2 2.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.488 0.661 . . . . 0.0 110.223 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.4 m -104.49 101.02 10.7 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.94 -177.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.411 ' HG3' ' HA3' ' A' ' 137' ' ' GLY . 34.9 tt0 -84.98 -43.48 13.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.556 -173.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -62.68 -52.88 61.55 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -103.68 100.56 10.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.519 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.498 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -77.74 85.52 4.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.967 0.413 . . . . 0.0 110.391 178.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.405 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 5.4 t80 -170.03 118.79 0.59 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.698 ' HB3' HD22 ' A' ' 145' ' ' LEU . 3.7 m95 71.37 10.6 6.64 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.782 0.676 . . . . 0.0 111.571 -178.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -136.45 -153.89 6.65 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.389 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.496 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 2.1 p-10 -91.52 -13.54 31.95 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.345 0.593 . . . . 0.0 109.846 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.498 ' HA2' ' HA ' ' A' ' 131' ' ' ALA . . . 77.06 -0.15 67.99 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.171 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.411 ' HA3' ' HG3' ' A' ' 128' ' ' GLU . . . 81.25 15.93 75.48 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.361 -0.447 . . . . 0.0 112.719 -177.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -168.1 -24.79 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -177.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 141.49 -49.65 0.76 Allowed Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.256 -0.973 . . . . 0.0 112.499 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -82.94 62.76 6.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.33 0.586 . . . . 0.0 110.126 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.18 8.62 9.03 Favored Glycine 0 C--N 1.315 -0.616 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.787 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 49.9 mttp 62.48 63.67 1.0 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 122.509 0.323 . . . . 0.0 111.228 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.427 ' OD1' HG13 ' A' ' 124' ' ' VAL . 6.4 t30 -72.66 5.16 3.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.96 0.41 . . . . 0.0 111.304 -177.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.636 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 44.7 ttm180 -47.6 -25.91 1.3 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.761 177.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.698 HD22 ' HB3' ' A' ' 133' ' ' TRP . 20.4 tp -53.9 -47.17 71.43 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.857 0.36 . . . . 0.0 110.391 175.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -62.93 -36.05 92.89 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.96 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . 0.435 ' HA ' ' HE3' ' A' ' 150' ' ' MET . 86.4 t80 -67.08 -41.3 86.57 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 176.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 82.1 mt -61.1 -40.23 92.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.235 -0.439 . . . . 0.0 109.93 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.459 HD21 HD22 ' A' ' 101' ' ' LEU . 96.1 mt -60.06 -46.86 88.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.53 174.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.512 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 74.2 mtm -67.5 -39.54 85.17 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.798 -178.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -70.71 -35.62 72.84 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.542 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 54.9 tp -61.95 -45.77 92.24 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 173.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.739 ' HB2' ' HG ' ' A' ' 115' ' ' LEU . 0.6 OUTLIER -52.01 -42.46 63.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.877 175.461 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -62.03 -38.24 87.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.732 -177.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -73.48 -38.72 65.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.845 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 41.0 mt -67.09 -23.28 65.83 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.084 0.468 . . . . 0.0 110.715 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.32 72.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.218 173.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.56 -33.54 64.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.699 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.25 -49.65 63.63 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.36 0.6 . . . . 0.0 110.97 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 13.7 mttp -87.06 -20.83 26.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.296 -176.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 11.5 tp -63.7 -27.9 69.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.34 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.01 6.56 0.5 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.803 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -60.79 -24.1 65.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.598 175.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -70.57 108.05 4.16 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 170.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -113.9 98.61 7.11 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.805 0.812 . . . . 0.0 112.907 -167.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 21.3 t60 -128.06 27.65 5.64 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 166.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -87.55 65.64 8.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.757 -1.11 . . . . 0.0 109.575 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 . . . . . 0 C--O 1.249 1.056 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.567 -177.364 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.426 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 23.8 mmt . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 1' ' ' MET . 5.0 Cg_exo -78.81 101.49 1.45 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.793 2.329 . . . . 0.0 111.739 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -129.58 -35.62 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.564 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 65.89 -81.13 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.957 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 61.1 90.77 0.06 Allowed 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.946 0.779 . . . . 0.0 111.919 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.494 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 12.5 mm-40 -66.77 108.97 2.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.336 0.589 . . . . 0.0 111.127 176.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -83.76 112.98 20.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.014 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.3 tt -76.23 -26.38 17.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.001 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 62.85 80.75 0.22 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.785 -177.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 66.67 -179.53 0.21 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.434 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.484 HG11 ' HB2' ' A' ' 121' ' ' ALA . 28.3 m -129.25 -174.41 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.631 173.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.2 mmt -93.71 -74.26 0.54 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.17 0.509 . . . . 0.0 110.463 -173.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -176.48 121.83 0.15 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.929 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.6 t70 54.33 39.95 31.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.792 0.806 . . . . 0.0 110.055 -176.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.4 m -76.31 140.66 41.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.139 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.434 HG12 ' HB3' ' A' ' 122' ' ' LYS . 61.2 mt -115.62 121.51 67.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.4 mt -103.88 111.0 31.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.001 -175.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.611 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 8.5 m120 -87.88 101.34 13.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.968 173.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.511 ' CD1' ' HB2' ' A' ' 29' ' ' PHE . 42.6 p90 -101.24 128.54 47.31 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.996 0.426 . . . . 0.0 110.962 -178.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -150.57 -179.19 7.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 173.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.0 m 71.3 84.82 0.13 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.638 0.732 . . . . 0.0 110.658 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.92 -9.82 58.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.233 -175.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.5 m -99.4 3.02 45.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.737 0.304 . . . . 0.0 110.855 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -93.35 -84.83 0.29 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.339 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -171.81 -46.6 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.595 0.236 . . . . 0.0 111.072 174.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -84.18 -4.8 59.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.366 0.603 . . . . 0.0 110.605 -174.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -79.13 -0.3 82.17 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.734 -0.667 . . . . 0.0 112.274 177.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -51.28 -33.5 28.88 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -177.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.511 ' HB2' ' CD1' ' A' ' 19' ' ' PHE . 89.0 m-85 -56.98 -19.07 16.12 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -176.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.3 t -75.45 147.71 39.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.197 0.522 . . . . 0.0 110.45 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -73.27 -10.03 59.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.214 -176.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -90.15 8.35 33.36 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.408 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.35 139.22 55.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.163 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.539 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -82.67 57.35 3.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.599 -176.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.447 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 76.1 m95 -118.32 115.92 35.74 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.493 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 35' ' ' TRP . 19.4 Cg_endo -60.48 136.61 68.68 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.996 2.464 . . . . 0.0 112.386 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.561 HG22 ' HA ' ' A' ' 104' ' ' LYS . 24.4 pt -123.8 176.43 5.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.053 -178.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 42.2 tptt -131.4 100.37 5.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.3 t -119.01 130.06 74.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.936 -174.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 62.8 9.52 3.69 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 124.044 0.84 . . . . 0.0 111.362 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.94 4.02 42.11 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.82 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -120.21 146.17 46.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 117.188 0.494 . . . . 0.0 110.952 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.1 m -79.17 131.67 36.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.303 176.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.443 ' HB2' HG13 ' A' ' 37' ' ' ILE . 86.8 m95 -122.46 137.26 27.48 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 176.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.44 -36.55 98.76 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.672 2.248 . . . . 0.0 112.437 -178.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.539 HG22 ' HA ' ' A' ' 34' ' ' ALA . 81.0 p -148.18 174.16 12.26 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.3 m -72.85 -28.42 62.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.307 0.575 . . . . 0.0 109.913 174.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -68.47 -36.09 78.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.256 -179.706 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.405 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 34.4 m80 -62.37 -36.39 82.12 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.407 0.146 . . . . 0.0 111.31 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -72.57 -37.85 68.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.014 0.435 . . . . 0.0 109.952 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -62.42 -47.62 83.28 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.726 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.574 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 64.6 mm-40 -64.72 -44.88 88.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.363 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.437 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -60.41 -36.54 78.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.305 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -71.26 -29.4 65.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.573 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.606 ' HE3' HD21 ' A' ' 85' ' ' LEU . 75.3 tttt -65.37 -43.64 90.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.787 176.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.728 ' HE1' ' HG3' ' A' ' 83' ' ' LYS . 75.5 m-85 -73.64 109.85 7.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.752 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.556 HD11 ' HB3' ' A' ' 86' ' ' ARG . 11.2 mp -85.3 34.6 0.57 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.811 0.815 . . . . 0.0 108.983 168.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 56' ' ' PHE . 9.9 t0 -116.59 111.02 19.3 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.387 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -55.08 -56.14 23.2 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -171.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 60' ' ' LYS . 4.3 mptp? -72.4 -26.39 61.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.603 0.239 . . . . 0.0 111.489 -176.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.558 ' O ' HG12 ' A' ' 65' ' ' ILE . 0.4 OUTLIER -74.5 -37.93 62.99 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 178.044 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.437 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.0 ttm180 -61.76 -40.78 96.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.182 0.515 . . . . 0.0 109.958 175.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.39 -39.7 94.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.723 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -64.2 -37.87 89.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.547 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.558 HG12 ' O ' ' A' ' 61' ' ' TYR . 44.5 mm -65.42 -35.2 74.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.863 0.363 . . . . 0.0 111.042 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.04 -22.45 52.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.268 0.556 . . . . 0.0 109.562 176.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -79.11 -18.8 52.61 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.417 -176.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.9 m -93.76 131.12 41.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.345 0.593 . . . . 0.0 110.726 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.2 p -88.0 -18.88 28.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.287 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.436 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 42.0 t -80.89 124.49 81.48 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.928 -177.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 18.5 Cg_exo -68.15 -39.81 9.83 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.236 2.624 . . . . 0.0 111.992 177.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.9 tpt -65.57 -35.35 80.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.757 -176.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.655 ' O ' ' HG2' ' A' ' 77' ' ' MET . 92.8 t -66.98 -44.15 88.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.392 178.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.39 -40.03 85.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.947 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.77 -37.79 85.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.8 0.334 . . . . 0.0 110.429 175.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -64.13 -37.9 89.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.302 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.655 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 6.7 mmt -60.31 -57.13 14.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.5 0.667 . . . . 0.0 109.973 176.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.574 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -80.5 3.08 75.35 Favored Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.121 -0.945 . . . . 0.0 113.346 -174.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -80.2 -19.54 46.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 117.088 0.444 . . . . 0.0 110.1 175.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -79.08 172.56 13.64 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.894 0.378 . . . . 0.0 110.001 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -134.14 1.69 3.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.949 0.404 . . . . 0.0 110.321 -176.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.6 p -88.24 -5.16 58.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.96 0.41 . . . . 0.0 111.58 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.807 ' HE3' ' HD2' ' A' ' 84' ' ' PRO . 30.4 mmmt -89.96 151.54 45.34 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.751 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.807 ' HD2' ' HE3' ' A' ' 83' ' ' LYS . 18.9 Cg_endo -57.19 119.01 5.99 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.286 2.658 . . . . 0.0 113.182 -177.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.606 HD21 ' HE3' ' A' ' 55' ' ' LYS . 57.8 mt -107.18 169.02 8.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.186 178.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.568 ' HG2' ' HB2' ' A' ' 89' ' ' TRP . 12.7 ptm180 -100.28 175.95 5.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.822 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -60.11 -69.31 0.22 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.253 -171.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -97.38 36.38 1.48 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.792 0.33 . . . . 0.0 111.108 -176.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.599 ' CZ2' ' HB2' ' A' ' 55' ' ' LYS . 33.3 t-105 -58.66 -35.13 72.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.859 0.361 . . . . 0.0 111.75 -178.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.428 ' CD ' ' HZ3' ' A' ' 93' ' ' LYS . 63.7 mm-40 -73.5 -16.99 61.27 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.295 -177.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.9 m -99.69 -37.54 9.07 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.877 0.37 . . . . 0.0 111.282 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.404 ' O ' HG23 ' A' ' 96' ' ' VAL . 34.0 m -85.81 3.01 4.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -172.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.526 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 59.0 mttp -55.11 -46.49 75.57 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.061 0.458 . . . . 0.0 111.5 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.456 ' HG2' ' H ' ' A' ' 94' ' ' GLU . 3.9 pt-20 -68.06 -25.43 65.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.348 -177.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -75.03 -43.81 51.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.906 0.384 . . . . 0.0 110.117 176.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 92' ' ' VAL . 88.9 t -61.16 -47.33 94.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.643 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.8 mtt -65.94 -32.94 74.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.492 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.687 HH21 HD23 ' A' ' 148' ' ' LEU . 27.7 ttm180 -60.87 -43.87 97.82 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.842 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -69.51 -40.49 76.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.76 0.314 . . . . 0.0 110.543 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.1 -47.64 76.48 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.45 HD13 HD21 ' A' ' 149' ' ' LEU . 69.9 mt -66.8 -37.04 83.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.291 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.511 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 52.1 ttt180 -60.21 -48.78 80.3 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.826 177.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.567 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -58.52 -30.43 67.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.889 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.561 ' HA ' HG22 ' A' ' 37' ' ' ILE . 55.9 tttt -66.05 -55.0 18.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.16 177.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -74.9 -10.87 59.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.099 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.539 ' HA ' HH21 ' A' ' 112' ' ' ARG . 60.3 mt-10 -88.3 -27.79 21.48 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.885 0.374 . . . . 0.0 110.395 172.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.567 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 1.3 tp-100 -86.42 -30.82 21.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.732 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -115.24 111.75 21.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.664 0.269 . . . . 0.0 110.818 -177.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.02 -39.35 91.99 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.974 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -53.38 -47.53 69.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.081 0.467 . . . . 0.0 110.93 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.441 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 22.3 mt -74.95 -31.16 61.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.439 -176.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.539 HH21 ' HA ' ' A' ' 106' ' ' GLU . 6.7 tpp180 -56.92 -50.45 72.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.529 176.003 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.99 -38.62 76.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.895 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 60.2 tp -60.3 -45.17 94.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 35.0 tp -62.08 -44.48 96.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.086 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.531 HD21 ' HB2' ' A' ' 156' ' ' LEU . 38.6 mt -74.72 -18.17 60.54 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.66 0.267 . . . . 0.0 111.21 -177.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.95 -23.22 52.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.446 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 57.9 p -71.88 -24.64 61.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.883 0.373 . . . . 0.0 110.931 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.474 ' HB2' ' HE ' ' A' ' 153' ' ' ARG . . . -47.84 136.47 10.62 Favored Pre-proline 0 C--O 1.234 0.25 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.891 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.432 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 27.6 Cg_endo -100.78 33.3 8.6 Favored 'Cis proline' 0 CA--C 1.534 0.511 0 C-N-CA 124.26 -1.142 . . . . 0.0 113.641 -1.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.484 ' HB2' HG11 ' A' ' 11' ' ' VAL . . . -67.53 159.06 30.5 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -175.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.434 ' HB3' HG12 ' A' ' 16' ' ' ILE . 44.3 tttp -88.27 121.33 30.54 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.759 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.0 mt -90.09 114.34 26.24 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.787 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.611 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 61.6 t -129.61 114.96 32.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.625 -0.262 . . . . 0.0 111.118 -178.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -74.18 118.53 17.24 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.513 ' HA ' ' HB2' ' A' ' 135' ' ' ASP . 80.8 t60 -85.53 77.51 9.85 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.865 -0.734 . . . . 0.0 109.188 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.51 107.31 9.87 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.633 178.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -106.61 15.93 25.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.553 0.692 . . . . 0.0 110.404 -175.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -125.98 -25.04 3.65 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.371 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -131.86 136.78 47.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.49 176.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.53 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -99.9 85.81 3.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.34 0.591 . . . . 0.0 109.843 173.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 133' ' ' TRP . 5.6 t80 178.07 140.32 0.09 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.006 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.752 ' HB3' HD22 ' A' ' 145' ' ' LEU . 12.2 m95 74.93 6.29 4.33 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.872 0.732 . . . . 0.0 112.089 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -172.3 -113.85 0.31 Allowed Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 118.572 -1.775 . . . . 0.0 114.369 -178.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.513 ' HB2' ' HA ' ' A' ' 126' ' ' HIS . 9.8 t70 -98.57 -49.42 4.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.068 -0.566 . . . . 0.0 112.007 -167.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.53 ' HA2' ' HA ' ' A' ' 131' ' ' ALA . . . 82.6 -6.22 70.41 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.981 -177.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 94.2 16.95 41.86 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.586 -0.606 . . . . 0.0 111.586 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 20.4 p80 -168.6 24.91 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.501 -0.35 . . . . 0.0 111.005 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 79.08 -46.29 2.93 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.389 -0.434 . . . . 0.0 113.891 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -88.25 68.18 8.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.126 0.965 . . . . 0.0 110.67 -173.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -122.87 15.42 8.38 Favored Glycine 0 C--N 1.311 -0.82 0 CA-C-N 114.002 -1.454 . . . . 0.0 111.86 177.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 45.9 mttt 72.55 80.87 0.14 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.492 0.663 . . . . 0.0 111.36 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.406 HD21 ' HA ' ' A' ' 124' ' ' VAL . 4.9 t-20 -67.49 4.79 0.93 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.741 -1.118 . . . . 0.0 111.774 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.724 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 12.3 ttp180 -58.22 -22.1 50.61 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.866 -0.521 . . . . 0.0 112.239 -175.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.752 HD22 ' HB3' ' A' ' 133' ' ' TRP . 41.8 tp -66.08 -48.47 70.86 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 174.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -64.46 -28.9 73.77 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 174.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -68.83 -37.31 79.08 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 79.7 mt -58.85 -47.61 84.27 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 172.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.45 HD21 HD13 ' A' ' 101' ' ' LEU . 96.0 mt -61.77 -38.5 88.23 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.866 178.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.408 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 72.4 mtm -72.11 -40.16 68.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.656 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -67.19 -38.66 85.75 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.121 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.541 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 61.3 tp -62.32 -46.21 89.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.687 174.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.474 ' HE ' ' HB2' ' A' ' 119' ' ' ALA . 2.8 ttp-105 -52.23 -44.99 65.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.644 175.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -67.44 -38.83 85.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.6 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -72.61 -35.62 67.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.903 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 152' ' ' LEU . 76.5 mt -74.78 -23.54 58.53 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 176.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.404 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -72.4 -25.16 61.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.441 175.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.73 -39.75 82.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 175.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -63.34 -38.54 91.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.341 174.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -63.88 -41.1 97.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.23 176.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . 0.404 HD13 ' O ' ' A' ' 157' ' ' ALA . 8.3 mp -67.4 -46.26 73.78 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.423 178.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -84.53 11.31 8.96 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 164' ' ' HIS . 0.7 OUTLIER -66.66 139.37 57.85 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.582 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . 0.417 ' HB2' ' O ' ' A' ' 163' ' ' HIS . 32.2 t-80 164.99 -41.42 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -170.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -139.55 31.14 2.09 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.636 176.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.437 ' O ' ' HB2' ' A' ' 167' ' ' HIS . 1.7 m-70 -111.07 75.22 0.91 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 166' ' ' HIS . 74.5 m80 73.44 -43.7 0.56 Allowed 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.978 0.799 . . . . 0.0 109.137 -167.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 . . . . . 0 C--O 1.249 1.061 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 168.715 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.5 mtm . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -78.24 -167.5 0.5 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 122.647 2.231 . . . . 0.0 112.215 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 37.6 t -84.83 85.82 2.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.297 0.57 . . . . 0.0 110.312 -179.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -107.42 29.8 6.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.314 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.85 76.75 1.15 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.142 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -151.53 118.17 5.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.577 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -165.34 -33.83 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.545 175.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 65.8 mt -87.69 108.37 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.601 176.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.434 HE21 ' HB2' ' A' ' 9' ' ' GLN . 10.1 mt-30 -62.1 -61.81 2.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.652 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -172.59 127.04 0.51 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.971 -1.013 . . . . 0.0 108.556 176.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.4 m -70.99 151.38 9.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.966 0.413 . . . . 0.0 110.556 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.481 ' HG2' ' OG1' ' A' ' 15' ' ' THR . 0.0 OUTLIER -75.35 -66.66 0.74 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.234 -178.617 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' MET . 58.3 tt0 174.51 -39.11 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.164 -0.925 . . . . 0.0 109.047 176.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -82.78 12.28 4.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.431 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.501 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 18.0 m -82.44 138.75 34.31 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.576 -174.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.635 HG12 ' HE3' ' A' ' 122' ' ' LYS . 61.2 mt -124.81 120.81 59.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.201 174.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.2 mp -89.98 101.22 12.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.628 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 18.7 m120 -91.77 101.06 13.66 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 176.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.428 ' HB2' ' CB ' ' A' ' 26' ' ' TYR . 37.1 p90 -107.38 174.82 5.72 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.344 -174.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.57 -179.26 5.58 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.266 -177.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.481 ' HA ' ' OG ' ' A' ' 30' ' ' SER . 17.2 m -64.51 -173.51 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.84 0.713 . . . . 0.0 112.356 -176.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.718 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 34.2 p -67.34 2.69 1.55 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -169.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.4 t -92.93 12.06 25.15 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.372 0.606 . . . . 0.0 109.801 176.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -129.22 166.63 19.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.172 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -61.55 -35.29 77.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.893 0.378 . . . . 0.0 110.668 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.428 ' CB ' ' HB2' ' A' ' 19' ' ' PHE . 98.8 m-85 -80.76 -1.42 42.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.954 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.718 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -57.03 -23.0 44.69 Favored Glycine 0 CA--C 1.52 0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 114.408 -174.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -69.44 -14.19 62.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 117.524 0.662 . . . . 0.0 111.27 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -73.44 -38.92 65.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.801 -0.181 . . . . 0.0 110.851 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.481 ' OG ' ' HA ' ' A' ' 21' ' ' SER . 64.6 m -59.27 158.84 8.51 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.674 0.749 . . . . 0.0 112.964 -173.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -69.96 -19.82 63.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.549 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.624 ' CE1' ' HB2' ' A' ' 71' ' ' PRO . 13.0 t80 -92.54 7.24 44.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.542 -176.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.417 ' HB1' ' HD1' ' A' ' 35' ' ' TRP . . . -72.52 129.0 37.3 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.593 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.521 ' HA ' HG23 ' A' ' 46' ' ' THR . . . -80.17 60.39 3.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.255 0.55 . . . . 0.0 111.387 -175.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.417 ' HD1' ' HB1' ' A' ' 33' ' ' ALA . 58.5 m95 -111.16 112.43 55.15 Favored Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.388 174.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.446 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 42.2 Cg_exo -57.13 126.91 23.65 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 123.183 2.589 . . . . 0.0 113.237 -175.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.504 ' CG1' ' HB2' ' A' ' 44' ' ' TRP . 37.6 pt -103.33 145.2 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.49 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.514 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 14.9 tptm -108.39 92.59 4.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.957 0.408 . . . . 0.0 109.901 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 26.1 t -121.33 128.25 75.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.136 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.7 t70 66.8 16.91 10.49 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.811 0.815 . . . . 0.0 110.255 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.9 10.97 83.34 Favored Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.703 -176.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 57.6 mttp -111.01 143.26 41.98 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 56.8 m -94.48 113.28 25.1 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.534 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.504 ' HB2' ' CG1' ' A' ' 37' ' ' ILE . 62.4 m95 -104.31 126.0 32.72 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 176.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 23.3 Cg_exo -62.91 -13.63 36.01 Favored 'Trans proline' 0 N--CA 1.473 0.281 0 C-N-CA 123.177 2.585 . . . . 0.0 113.059 -175.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.521 HG23 ' HA ' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -164.91 151.8 10.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.069 -178.256 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.9 m -58.53 -34.1 70.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.102 0.477 . . . . 0.0 109.954 175.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 51' ' ' PHE . 15.9 tm-20 -54.1 -42.97 69.98 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.311 177.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -69.54 -37.19 76.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.6 -175.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.468 ' CE2' HG13 ' A' ' 96' ' ' VAL . 90.8 t80 -69.91 -35.95 75.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 176.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.476 ' CZ ' ' HZ2' ' A' ' 89' ' ' TRP . 68.6 t80 -56.29 -52.51 64.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.761 177.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.638 ' NE2' ' HA ' ' A' ' 75' ' ' ALA . 17.1 mm-40 -66.81 -50.11 63.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.134 -178.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.51 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -58.51 -30.47 67.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.353 -177.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.505 HE21 ' HA ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -78.4 -42.92 28.82 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.154 178.216 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.549 ' HG2' HD22 ' A' ' 85' ' ' LEU . 27.3 ttpp -57.06 -39.65 75.32 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.158 -177.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -92.46 139.77 30.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.401 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.825 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.5 pt? -113.45 18.4 17.73 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.371 0.605 . . . . 0.0 110.275 -178.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -96.11 128.25 42.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.631 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -60.75 -48.01 83.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.463 -177.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -59.12 -46.38 88.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.701 0.286 . . . . 0.0 111.498 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.522 ' CZ ' ' HE3' ' A' ' 83' ' ' LYS . 2.5 t80 -74.39 -32.59 62.78 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.01 -174.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.51 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 41.7 ttm180 -64.88 -35.32 80.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.226 0.536 . . . . 0.0 109.618 174.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.537 ' HG2' ' HD3' ' A' ' 67' ' ' ARG . 31.1 tt0 -70.24 -31.39 68.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.247 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -59.8 -48.85 80.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.042 0.449 . . . . 0.0 110.154 173.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.436 HG21 ' HB2' ' A' ' 52' ' ' GLN . 37.8 mm -62.14 -37.98 79.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.005 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -71.38 -23.81 61.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.019 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.537 ' HD3' ' HG2' ' A' ' 63' ' ' GLU . 25.5 mtp180 -99.78 13.68 32.87 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -173.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.7 m -118.69 132.41 68.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.073 0.463 . . . . 0.0 110.35 174.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.9 m -84.91 -30.72 24.14 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.084 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.431 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 39.6 m -81.19 122.2 81.2 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.036 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.624 ' HB2' ' CE1' ' A' ' 32' ' ' PHE . 10.8 Cg_exo -70.97 -33.31 12.2 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 123.073 2.515 . . . . 0.0 111.795 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.451 ' O ' ' HG3' ' A' ' 76' ' ' ARG . 52.3 ttm -60.82 -39.51 89.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.803 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.516 ' O ' ' HG3' ' A' ' 77' ' ' MET . 84.1 t -61.15 -52.0 66.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.327 177.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.7 98.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.025 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.638 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -60.32 -50.33 74.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.596 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 72' ' ' MET . 77.1 mtp180 -64.77 -47.78 76.93 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -175.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.516 ' HG3' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -85.01 -8.29 58.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.979 0.419 . . . . 0.0 111.391 -177.696 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -93.87 -17.09 42.36 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.916 176.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -89.87 -1.15 57.92 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -175.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -82.37 131.23 35.23 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.018 174.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -106.13 22.68 15.29 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.626 0.727 . . . . 0.0 110.459 -170.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 59.8 m -70.87 -36.8 72.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.729 173.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.522 ' HE3' ' CZ ' ' A' ' 61' ' ' TYR . 16.1 pttm -86.53 158.12 54.74 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.797 175.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.438 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 60.7 Cg_endo -71.71 154.71 59.28 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.616 2.211 . . . . 0.0 113.473 -174.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.549 HD22 ' HG2' ' A' ' 55' ' ' LYS . 52.9 mt -121.57 171.95 8.45 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 175.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -70.79 141.18 51.4 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.7 -0.8 . . . . 0.0 109.37 174.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.471 ' HE3' ' HB2' ' A' ' 87' ' ' LYS . 35.1 ttmt -61.24 -46.66 89.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.168 -169.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -86.75 24.29 1.5 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.485 ' HA ' HG22 ' A' ' 92' ' ' VAL . 65.7 t-105 -59.06 -36.03 74.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.737 0.304 . . . . 0.0 111.56 -177.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.89 -30.46 67.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.839 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 28.8 m -94.8 -40.58 9.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.849 0.356 . . . . 0.0 111.075 -177.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.5 m -79.06 -8.08 11.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -176.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 97' ' ' MET . 62.3 tttp -52.83 -46.5 67.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.653 0.264 . . . . 0.0 111.155 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -77.63 -28.83 51.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.696 0.284 . . . . 0.0 111.061 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -68.88 -42.25 77.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.088 0.471 . . . . 0.0 109.988 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.468 HG13 ' CE2' ' A' ' 50' ' ' TYR . 75.4 t -61.35 -46.76 95.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.396 176.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.456 ' HG2' ' O ' ' A' ' 93' ' ' LYS . 83.2 mmm -61.04 -40.07 92.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.809 178.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 25.7 ttm-85 -62.26 -43.64 98.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.544 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -61.9 -44.46 96.75 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.884 0.373 . . . . 0.0 110.589 178.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.92 -44.21 93.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.121 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -69.53 -41.22 76.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.014 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -58.34 -53.67 55.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.539 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.97 -26.56 68.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.949 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -65.06 -55.31 19.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.64 178.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -79.3 -6.39 56.61 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.947 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.778 ' HA ' HH21 ' A' ' 112' ' ' ARG . 20.9 mt-10 -92.08 -35.45 13.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.598 0.237 . . . . 0.0 110.999 173.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.514 ' NE2' ' HB2' ' A' ' 38' ' ' LYS . 0.8 OUTLIER -66.41 -45.1 81.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.027 0.442 . . . . 0.0 110.364 179.23 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -113.81 111.41 21.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.114 -176.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.36 -22.14 66.25 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.61 178.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -57.12 -49.02 77.21 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.362 0.601 . . . . 0.0 109.873 175.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.8 mt -69.32 -38.39 78.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.231 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.778 HH21 ' HA ' ' A' ' 106' ' ' GLU . 42.5 ttm180 -58.42 -43.7 88.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.508 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.94 -43.03 99.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.836 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.7 tp -65.97 -40.15 91.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.537 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.665 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 44.0 tp -65.62 -35.39 80.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.985 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.1 mp -88.55 -3.77 58.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.881 0.372 . . . . 0.0 111.077 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.12 -34.73 24.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.048 0.452 . . . . 0.0 109.792 172.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 20.9 p -75.23 -14.96 60.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.936 176.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.414 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -59.3 138.23 88.65 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.275 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 67.7 Cg_endo -104.99 39.66 3.47 Favored 'Cis proline' 0 N--CA 1.458 -0.6 0 C-N-CA 124.819 -0.909 . . . . 0.0 113.2 -2.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.501 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -75.48 176.28 7.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.94 0.4 . . . . 0.0 111.821 -176.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.635 ' HE3' HG12 ' A' ' 16' ' ' ILE . 51.6 mtmt -92.92 130.78 38.39 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.187 -179.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 59.8 mt -94.07 113.62 25.62 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.993 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.628 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 86.1 t -132.82 107.07 11.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.494 -175.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -77.34 117.82 19.2 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.439 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 7.4 t60 -85.71 113.32 21.81 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 3.6 t -136.95 112.49 9.34 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.382 0.611 . . . . 0.0 109.896 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.0 18.73 17.74 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.043 0.925 . . . . 0.0 108.548 171.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -95.53 -44.46 7.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.125 177.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -130.02 166.74 19.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.148 176.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.64 86.34 2.23 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.405 175.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -160.11 -35.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.124 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.671 ' HB3' HD22 ' A' ' 145' ' ' LEU . 71.5 m95 -120.79 20.71 11.63 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.485 -179.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -150.73 -150.31 5.26 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.43 -175.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.439 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 1.3 p-10 -82.43 -14.93 54.32 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 122.291 -0.534 . . . . 0.0 110.334 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.569 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 68.0 26.42 73.99 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.886 176.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 76.81 -27.26 1.64 Allowed Glycine 0 CA--C 1.52 0.375 0 N-CA-C 114.31 0.484 . . . . 0.0 114.31 176.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . 0.468 ' NE2' ' HB3' ' A' ' 140' ' ' LYS . 20.7 p-80 -132.65 11.78 4.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.518 0.659 . . . . 0.0 111.801 -172.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 99.32 -27.09 21.72 Favored Glycine 0 CA--C 1.517 0.166 0 C-N-CA 120.552 -0.832 . . . . 0.0 113.048 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.468 ' HB3' ' NE2' ' A' ' 138' ' ' HIS . 65.6 tttp -107.4 69.97 0.77 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.587 0.708 . . . . 0.0 110.025 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.569 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -124.19 15.23 7.78 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.257 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 61.2 mttt 61.97 77.05 0.34 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.773 0.797 . . . . 0.0 110.929 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.424 ' OD1' HG13 ' A' ' 124' ' ' VAL . 8.8 t30 -77.9 5.58 9.39 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.75 -176.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.493 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 69.0 mtp85 -47.37 -22.22 0.4 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -178.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.671 HD22 ' HB3' ' A' ' 133' ' ' TRP . 49.2 tp -56.59 -47.54 79.37 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.272 0.558 . . . . 0.0 110.237 173.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.613 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -67.42 -27.96 73.59 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.792 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -68.93 -37.87 79.17 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 79.6 mt -61.26 -41.87 97.67 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.6 -34.33 78.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.837 177.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.613 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 67.4 mtt -61.48 -49.24 77.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.73 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -67.38 -37.15 82.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.71 0.29 . . . . 0.0 110.805 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 68.1 tp -63.67 -42.77 98.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.032 0.444 . . . . 0.0 110.065 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.665 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 1.1 ttp-105 -61.7 -42.55 99.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.954 177.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -57.52 -43.97 84.72 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.219 177.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -66.65 -45.5 78.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.255 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.503 HD12 HD23 ' A' ' 115' ' ' LEU . 90.9 mt -69.41 -28.16 65.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.828 0.347 . . . . 0.0 110.627 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -60.8 -45.46 94.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.186 175.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 69.8 mt -69.14 -34.07 61.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.72 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -56.39 -52.8 63.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.045 0.45 . . . . 0.0 109.79 177.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -76.44 -25.2 54.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.769 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 13.7 tp -70.11 -32.56 70.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.195 0.521 . . . . 0.0 110.005 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.13 -58.68 3.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.189 177.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 33.6 p80 42.7 28.7 0.13 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.495 1.118 . . . . 0.0 113.671 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -101.06 -34.29 9.79 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -68.4 132.37 46.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.155 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 50.7 m80 -104.36 -172.63 2.14 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.433 -178.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -89.08 130.76 35.48 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 177.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 30.5 m170 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.641 -0.695 . . . . 0.0 109.975 -175.495 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.408 ' O ' ' HG3' ' A' ' 1' ' ' MET . 24.0 ptm . . . . . 0 N--CA 1.48 1.067 0 CA-C-O 121.051 0.453 . . . . 0.0 110.436 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -85.98 155.77 9.94 Favored 'Trans proline' 0 N--CA 1.453 -0.859 0 C-N-CA 122.441 2.094 . . . . 0.0 111.706 177.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -69.5 125.7 28.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 176.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -82.68 84.79 7.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.667 0.746 . . . . 0.0 109.941 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.95 44.75 1.15 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.682 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -77.81 91.68 4.14 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 173.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.405 ' HG2' HD12 ' A' ' 114' ' ' LEU . 32.0 mtt85 -77.79 162.66 26.75 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.484 -1.235 . . . . 0.0 111.511 -169.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 54.1 mt -65.47 127.29 26.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.956 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.501 ' O ' ' HB2' ' A' ' 10' ' ' HIS . 21.6 mm-40 -77.53 65.64 3.09 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.138 -179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.501 ' HB2' ' O ' ' A' ' 9' ' ' GLN . 17.8 m80 74.23 123.64 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.954 -174.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.421 HG21 ' HB2' ' A' ' 121' ' ' ALA . 32.3 m -83.73 179.91 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.909 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 29.0 mtm -91.92 164.33 13.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.02 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -58.08 116.75 3.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.338 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 52.01 74.16 0.28 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.523 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.43 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 31.5 m -96.8 121.72 38.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.858 177.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 35.3 mm -81.33 95.78 2.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 176.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.9 mt -90.07 91.61 3.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.443 0.639 . . . . 0.0 109.794 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.62 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.3 p30 -96.49 101.96 13.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.421 178.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -102.81 132.08 49.24 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.519 -172.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -150.2 100.47 2.9 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.566 173.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.515 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 18.4 t 176.29 61.7 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -177.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.2 m -74.53 2.72 9.01 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.32 -171.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.36 -79.0 0.02 OUTLIER 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -175.37 81.65 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -170.55 -110.43 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.883 -172.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -101.26 -15.69 17.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.2 0.524 . . . . 0.0 110.243 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.515 ' HA3' ' O ' ' A' ' 21' ' ' SER . . . -74.08 -0.45 56.45 Favored Glycine 0 CA--C 1.52 0.364 0 CA-C-N 115.863 -0.608 . . . . 0.0 113.303 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.36 -1.56 3.57 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.023 0.44 . . . . 0.0 112.004 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.409 ' O ' ' HE2' ' A' ' 104' ' ' LYS . 15.3 m-85 -65.17 -32.31 73.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.578 169.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.9 m -62.99 156.71 23.82 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.437 0.637 . . . . 0.0 112.046 -174.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.624 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 5.5 p-10 -70.66 -24.93 62.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.906 178.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -76.6 -2.26 31.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.715 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.442 ' O ' HG22 ' A' ' 46' ' ' THR . . . -64.72 136.1 56.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.945 -177.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.79 57.83 2.66 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.456 -172.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 66.2 m95 -116.63 105.5 49.88 Favored Pre-proline 0 C--N 1.316 -0.86 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.607 177.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.27 138.18 78.86 Favored 'Trans proline' 0 C--O 1.238 0.482 0 C-N-CA 123.324 2.683 . . . . 0.0 113.029 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.403 HG13 ' HB2' ' A' ' 44' ' ' TRP . 16.2 pt -123.81 137.65 56.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.363 -178.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.413 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 46.1 tptt -98.66 107.67 20.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.423 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.0 t -123.72 113.27 36.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -174.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 55.27 36.72 27.65 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.437 172.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.08 -1.18 62.74 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.502 173.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HE3' ' CZ2' ' A' ' 44' ' ' TRP . 54.4 mtmt -129.34 144.7 51.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 117.635 0.718 . . . . 0.0 110.42 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.0 m -98.53 122.74 42.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.861 -175.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.478 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 41.5 m95 -112.16 134.55 21.44 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.642 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 37.9 Cg_exo -60.79 -41.63 44.56 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.833 2.355 . . . . 0.0 112.554 -177.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.442 HG22 ' O ' ' A' ' 33' ' ' ALA . 21.0 p -144.77 178.63 7.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.698 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.624 ' HB2' ' HB2' ' A' ' 31' ' ' ASN . 21.5 m -74.02 -44.1 55.62 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -173.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.494 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 1.9 pm0 -76.93 -10.31 59.28 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.502 -173.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.538 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 11.2 m80 -71.74 -38.01 70.49 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 172.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -71.46 -35.81 70.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.494 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 83.0 t80 -59.89 -56.42 21.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.549 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.521 ' NE2' ' HA3' ' A' ' 78' ' ' GLY . 5.1 mm100 -66.28 -21.7 66.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.211 -0.45 . . . . 0.0 112.016 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.457 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -76.32 -48.99 18.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.004 0.43 . . . . 0.0 110.455 176.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.47 -14.48 62.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.136 0.493 . . . . 0.0 110.338 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -60.64 -34.45 74.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.769 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.514 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 96.8 m-85 -109.17 157.7 18.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.383 -178.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.461 HD12 ' H ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -112.14 32.7 5.33 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.265 0.555 . . . . 0.0 111.1 -177.883 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.504 ' OD2' ' HB2' ' A' ' 60' ' ' LYS . 8.6 t70 -136.0 118.34 15.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.518 178.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.58 ' HA ' ' HB2' ' A' ' 62' ' ' ARG . 21.4 mm-40 -65.97 -14.07 60.93 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -177.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.504 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . 58.4 mttp -72.71 -55.11 7.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.96 0.409 . . . . 0.0 109.956 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.42 ' O ' HG12 ' A' ' 65' ' ' ILE . 55.2 t80 -71.6 -26.0 62.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.933 0.397 . . . . 0.0 110.321 177.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.58 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . 12.5 mtp180 -71.44 -27.34 63.21 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.805 0.336 . . . . 0.0 110.507 175.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.3 tt0 -69.91 -32.38 70.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 170.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.02 -40.75 95.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.591 175.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.42 HG12 ' O ' ' A' ' 61' ' ' TYR . 40.5 mm -65.16 -29.79 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.693 0.758 . . . . 0.0 110.29 175.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -74.58 -29.54 61.37 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.267 174.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -81.01 -28.47 35.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.207 -177.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.458 ' O ' HG13 ' A' ' 68' ' ' VAL . 10.3 p -70.83 101.37 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.722 0.772 . . . . 0.0 110.139 177.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.9 m -76.05 -26.17 56.32 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.966 -177.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.479 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.1 m -78.97 133.47 61.46 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.395 178.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.538 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 28.0 Cg_exo -62.12 -65.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.359 2.706 . . . . 0.0 113.986 -175.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 27.8 ttt -68.95 -26.45 65.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.776 0.322 . . . . 0.0 111.5 -172.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 86.3 t -62.82 -28.88 45.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.041 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.77 -47.49 84.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.031 0.443 . . . . 0.0 110.707 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.99 -30.52 62.52 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.95 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.42 ' HE ' ' C ' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -63.11 -49.12 75.65 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.574 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -77.54 -24.67 49.87 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 176.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.521 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -76.78 -2.14 75.17 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.274 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 76' ' ' ARG . 21.3 mmt180 -67.18 -18.77 65.41 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 122.31 0.244 . . . . 0.0 110.883 170.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.523 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 20.5 t70 -69.07 134.12 48.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.024 0.44 . . . . 0.0 110.402 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 81' ' ' ARG . 24.6 ttp-105 -118.18 17.87 13.89 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.278 -175.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 88.2 p -98.13 0.39 45.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.503 0.668 . . . . 0.0 109.593 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.523 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 41.1 mmtm -95.75 153.26 39.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 174.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.69 103.85 1.71 Allowed 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 121.44 1.426 . . . . 0.0 112.075 -178.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.416 HD21 ' HG3' ' A' ' 81' ' ' ARG . 2.4 pp -109.68 169.85 8.44 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.165 176.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 -86.07 133.23 33.9 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.04 -176.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -70.6 -33.39 71.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.842 0.353 . . . . 0.0 111.0 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -85.4 9.98 14.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.096 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.468 ' HA ' HG22 ' A' ' 92' ' ' VAL . 67.8 t-105 -54.5 -30.44 53.43 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.969 0.414 . . . . 0.0 110.203 175.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -53.66 -32.23 50.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.618 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.2 m -99.82 -45.46 5.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.698 0.285 . . . . 0.0 111.498 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.468 HG22 ' HA ' ' A' ' 89' ' ' TRP . 31.9 m -74.94 -11.22 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -171.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.4 pttm -63.27 -29.59 70.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.771 0.32 . . . . 0.0 110.647 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.495 ' OE1' ' HD3' ' A' ' 144' ' ' ARG . 9.5 mm-40 -68.16 -39.89 82.47 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.644 0.735 . . . . 0.0 109.49 177.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.87 -41.66 67.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.882 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.416 HG21 ' CZ3' ' A' ' 89' ' ' TRP . 79.7 t -63.8 -39.55 85.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.065 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.8 mmt -62.49 -46.14 89.81 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.576 176.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.719 HH21 HD23 ' A' ' 148' ' ' LEU . 26.1 ttm180 -63.75 -32.57 74.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.35 . . . . 0.0 110.545 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -63.93 -50.33 69.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.365 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.36 87.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.976 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.6 -35.52 80.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.098 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -58.88 -53.83 53.97 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.95 -37.51 82.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.739 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.409 ' HE2' ' O ' ' A' ' 29' ' ' PHE . 59.0 tttp -52.61 -54.02 38.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.357 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -86.5 -8.38 57.62 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.714 ' HA ' HH21 ' A' ' 112' ' ' ARG . 24.9 mt-10 -92.61 -33.01 14.58 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 121.868 -0.52 . . . . 0.0 111.518 175.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.413 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 78.5 mm-40 -79.17 -30.87 43.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.674 0.273 . . . . 0.0 110.761 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -115.28 103.38 10.76 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.778 0.323 . . . . 0.0 110.997 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.474 ' HA ' ' HB3' ' A' ' 112' ' ' ARG . . . -65.26 -24.42 67.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.513 178.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.517 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 2.0 mp0 -51.4 -56.08 15.13 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.455 172.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.9 mt -74.2 -31.65 62.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.333 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.714 HH21 ' HA ' ' A' ' 106' ' ' GLU . 13.7 tpp85 -50.48 -60.62 2.82 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.316 177.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.16 -34.35 70.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.025 -176.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.405 HD12 ' HG2' ' A' ' 7' ' ' ARG . 47.3 tp -61.91 -40.22 94.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.434 178.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 29.3 tp -67.64 -49.56 62.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.278 178.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.541 HD21 ' HB2' ' A' ' 156' ' ' LEU . 53.0 mt -63.56 -24.89 68.0 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -173.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -74.47 -7.22 52.28 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 72.0 p -86.8 -15.4 39.38 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.363 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.432 ' HA ' HH21 ' A' ' 153' ' ' ARG . . . -54.87 141.86 56.74 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.394 177.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.583 ' HA ' HH21 ' A' ' 153' ' ' ARG . 43.9 Cg_endo -101.22 41.94 3.45 Favored 'Cis proline' 0 CA--C 1.535 0.572 0 C-N-CA 124.5 -1.042 . . . . 0.0 113.134 -1.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.43 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -72.92 166.93 22.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.94 0.4 . . . . 0.0 111.704 -178.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 39.3 tttp -100.98 119.35 38.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.589 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 24.2 mt -88.7 125.35 34.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.433 -175.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.62 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 42.2 t -134.36 134.11 54.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.432 -175.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.517 ' HB3' ' HA3' ' A' ' 134' ' ' GLY . 0.0 OUTLIER -81.02 137.66 36.04 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.31 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 18' ' ' ASN . 23.7 t-160 -130.77 79.94 1.92 Allowed 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.55 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.5 t -87.55 166.22 14.9 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 164.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -140.16 67.75 1.37 Allowed 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.833 0.825 . . . . 0.0 110.454 -176.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -162.69 -44.85 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.866 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.507 ' O ' ' HA2' ' A' ' 136' ' ' GLY . 2.6 m-20 -125.9 -179.9 4.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -124.17 86.19 2.53 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 170.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -97.35 -49.55 4.88 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -167.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.629 ' HB3' ' HB2' ' A' ' 145' ' ' LEU . 78.9 m95 -140.06 25.18 2.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.457 0.646 . . . . 0.0 110.588 178.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.517 ' HA3' ' HB3' ' A' ' 125' ' ' GLU . . . -163.07 -84.22 0.05 OUTLIER Glycine 0 N--CA 1.439 -1.163 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.575 -177.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -160.1 164.28 33.17 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.502 -178.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.507 ' HA2' ' O ' ' A' ' 130' ' ' ASP . . . -98.38 24.12 33.32 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 175.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 74.24 37.27 48.76 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 115.071 -0.565 . . . . 0.0 113.748 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -144.58 -27.0 0.5 Allowed 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' A' ' 140' ' ' LYS . . . 99.71 56.44 0.96 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.282 -0.485 . . . . 0.0 113.218 174.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 139' ' ' GLY . 13.0 ttpp 169.86 69.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 123.675 0.79 . . . . 0.0 109.126 176.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -132.35 -65.11 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 119.333 -1.413 . . . . 0.0 114.363 -175.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 39.6 tttm -178.51 52.08 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.499 0.65 . . . . 0.0 111.088 -171.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.509 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 3.4 t-20 -69.28 5.29 1.32 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.076 0.95 . . . . 0.0 111.708 -177.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.702 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 1.6 ttt180 -57.58 -21.43 38.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.629 ' HB2' ' HB3' ' A' ' 133' ' ' TRP . 23.6 tp -65.53 -44.45 86.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.357 175.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -66.35 -32.14 81.06 Favored Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.177 175.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -61.85 -40.57 95.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.017 0.437 . . . . 0.0 110.032 175.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.719 HD23 HH21 ' A' ' 98' ' ' ARG . 46.4 mt -63.73 -45.5 89.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.767 174.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.4 mt -61.02 -46.24 91.53 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.33 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 58.1 mtm -64.84 -43.4 93.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.907 -176.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 155' ' ' GLN . 33.4 mt-10 -63.73 -44.97 91.96 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.64 176.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 58.7 tp -58.82 -45.21 90.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.182 0.515 . . . . 0.0 110.161 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.849 HH11 ' HB3' ' A' ' 153' ' ' ARG . 1.2 ttp-105 -57.82 -43.48 85.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.873 177.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.7 -40.79 97.66 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.802 177.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.896 HE21 ' HA ' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -65.87 -41.45 91.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.749 179.437 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.541 ' HB2' HD21 ' A' ' 116' ' ' LEU . 97.2 mt -66.13 -36.36 82.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.859 0.361 . . . . 0.0 110.267 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -63.72 -42.48 97.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.858 177.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 77.5 mt -70.22 -43.79 78.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.704 0.288 . . . . 0.0 111.046 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -62.71 -29.12 70.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.293 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -87.28 -29.66 21.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.433 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 15.9 tp -62.05 -35.49 78.79 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.879 -177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -79.68 11.72 3.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.782 -0.644 . . . . 0.0 112.175 -176.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -75.86 -8.37 56.72 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 122.284 -0.26 . . . . 0.0 111.344 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -68.37 -76.69 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.683 0.278 . . . . 0.0 110.867 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 22.1 t-80 -121.08 106.34 11.46 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 42.4 t60 -171.14 127.07 0.69 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.511 -170.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -91.42 -71.1 0.65 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.411 177.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.261 -0.876 . . . . 0.0 109.575 177.521 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.4 mtt . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 120.66 0.266 . . . . 0.0 110.574 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -69.18 93.45 0.47 Allowed 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.621 2.214 . . . . 0.0 111.878 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.479 ' O ' ' HB2' ' A' ' 25' ' ' ASP . 12.5 p -79.67 -22.96 12.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.355 -177.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 4' ' ' ARG . 14.7 mtp180 66.27 -79.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.303 -175.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.557 ' HB1' HD22 ' A' ' 114' ' ' LEU . . . 73.01 -40.29 0.47 Allowed 'General case' 0 N--CA 1.469 0.497 0 O-C-N 124.004 0.815 . . . . 0.0 112.062 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -68.46 100.98 1.16 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.905 0.383 . . . . 0.0 111.773 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -109.85 -42.14 4.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 168.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 38.3 pt -107.01 159.85 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.217 171.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.691 HE21 ' HA ' ' A' ' 9' ' ' GLN . 0.1 OUTLIER -144.23 108.69 4.84 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.155 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.2 t60 67.69 107.27 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.891 0.745 . . . . 0.0 110.935 -178.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -83.91 168.0 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.269 177.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.497 ' HG2' ' H ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -80.73 -84.55 0.1 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.965 -179.156 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.497 ' H ' ' HG2' ' A' ' 12' ' ' MET . 81.9 mm-40 -133.61 -72.17 0.5 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -175.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -137.16 86.8 2.23 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.712 -171.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.3 t -117.94 149.93 40.08 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.34 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.518 HD13 ' HB2' ' A' ' 122' ' ' LYS . 32.1 mm -94.68 113.18 28.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.924 177.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.0 mt -96.05 101.89 12.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 120.924 0.392 . . . . 0.0 110.301 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.428 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 22.9 m-80 -84.86 104.21 14.61 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.014 177.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -109.92 130.61 55.51 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.92 0.391 . . . . 0.0 110.467 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -150.54 137.82 19.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.968 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.1 m 73.18 130.41 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 O-C-N 124.144 0.902 . . . . 0.0 111.444 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.493 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 20.6 p -56.38 -30.7 63.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.827 -178.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.7 m 62.82 -85.94 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.691 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -160.41 -40.97 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 3' ' ' VAL . 4.3 p-10 -137.54 -52.7 0.65 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 120.154 -0.618 . . . . 0.0 112.595 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -77.68 -9.77 59.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.115 0.483 . . . . 0.0 111.59 -174.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.493 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -76.7 -0.52 68.55 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 116.187 -0.461 . . . . 0.0 113.279 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -53.07 -25.89 14.28 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -62.78 -18.91 63.42 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.9 m -78.84 136.73 37.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.978 0.418 . . . . 0.0 109.943 175.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -65.48 -15.65 62.87 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.837 -174.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.401 ' CE1' ' HB2' ' A' ' 71' ' ' PRO . 2.8 t80 -88.79 20.97 3.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.982 0.42 . . . . 0.0 110.955 -176.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.64 175.42 2.92 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.953 171.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -134.9 81.7 1.91 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.892 0.377 . . . . 0.0 111.681 -176.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.466 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 92.9 m95 -121.1 137.23 26.41 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.465 177.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 7.4 Cg_exo -72.03 112.08 3.33 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.748 2.299 . . . . 0.0 111.544 177.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.509 HG13 ' HB2' ' A' ' 44' ' ' TRP . 17.4 pt -107.27 117.21 52.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.319 0.58 . . . . 0.0 110.649 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -81.58 95.69 7.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.862 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.436 ' HB ' ' CD1' ' A' ' 44' ' ' TRP . 24.7 t -118.61 125.18 74.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.288 -177.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.6 t70 62.48 28.49 16.8 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.714 0.769 . . . . 0.0 110.07 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.32 7.34 87.78 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.375 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -117.67 137.23 52.8 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.648 0.261 . . . . 0.0 110.386 -176.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.1 m -87.72 98.03 11.22 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.434 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.509 ' HB2' HG13 ' A' ' 37' ' ' ILE . 66.9 m95 -90.41 126.19 57.3 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 11.2 Cg_exo -72.15 61.16 3.24 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.852 2.368 . . . . 0.0 112.418 178.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 48' ' ' GLU . 0.5 OUTLIER 93.2 165.15 0.03 OUTLIER 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.338 1.055 . . . . 0.0 111.323 172.821 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.4 p -52.41 -43.91 65.07 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.34 -173.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.405 ' H ' HG23 ' A' ' 46' ' ' THR . 21.7 tp10 -43.56 -45.28 6.56 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 123.553 0.533 . . . . 0.0 112.205 178.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -74.34 -46.17 42.45 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.141 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -60.72 -35.57 76.66 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.152 0.501 . . . . 0.0 110.522 175.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.473 ' CZ ' ' HZ2' ' A' ' 89' ' ' TRP . 81.4 t80 -59.95 -57.45 12.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.239 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -67.3 -34.0 76.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.324 -176.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.95 -30.65 71.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.902 0.382 . . . . 0.0 111.081 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.626 ' HG2' HG22 ' A' ' 96' ' ' VAL . 4.5 tp-100 -85.95 -26.89 25.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.114 0.483 . . . . 0.0 109.893 178.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -67.84 -47.87 67.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.385 -178.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -90.47 143.17 27.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.05 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.66 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.2 pt? -102.66 3.13 36.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.0 110.328 176.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.32 122.87 22.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.639 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -63.58 -51.01 67.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.655 -173.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 63' ' ' GLU . 24.9 ttpp -68.44 -34.21 75.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.817 0.341 . . . . 0.0 110.359 -177.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.658 ' O ' HG12 ' A' ' 65' ' ' ILE . 2.0 t80 -68.34 -34.53 76.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.316 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.412 ' NH2' ' HA ' ' A' ' 57' ' ' LEU . 93.6 mtt180 -62.1 -35.72 79.54 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.989 0.423 . . . . 0.0 110.193 174.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.475 ' HB3' ' O ' ' A' ' 60' ' ' LYS . 10.1 tp10 -61.2 -45.65 93.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.696 174.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -62.04 -35.16 77.76 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.547 176.693 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 61' ' ' TYR . 48.9 mm -62.51 -40.35 87.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.795 0.331 . . . . 0.0 110.766 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -90.03 -0.41 57.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.173 0.511 . . . . 0.0 110.456 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.524 ' HB2' ' HA ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -83.03 -30.31 28.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.328 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.1 m -90.96 133.46 32.62 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.136 -176.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.3 m -81.72 -38.95 24.96 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.641 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.443 ' HB2' HG23 ' A' ' 73' ' ' VAL . 17.0 m -77.9 124.77 86.18 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.266 -177.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.401 ' HB2' ' CE1' ' A' ' 32' ' ' PHE . 35.5 Cg_endo -65.5 -27.86 53.93 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.72 2.28 . . . . 0.0 111.724 177.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 79.6 mtp -60.2 -39.24 85.87 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.887 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.571 ' O ' ' HG2' ' A' ' 77' ' ' MET . 46.0 t -66.53 -43.62 90.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.02 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.23 -47.37 85.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.941 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.543 ' O ' ' HG3' ' A' ' 79' ' ' ARG . . . -61.1 -47.8 84.63 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.891 0.377 . . . . 0.0 111.039 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -58.25 -49.56 76.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.86 -177.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.571 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 26.0 ptt? -81.66 -11.53 59.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.79 0.329 . . . . 0.0 110.94 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -81.26 -16.51 73.97 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.013 -0.613 . . . . 0.0 111.892 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 75' ' ' ALA . 92.9 mtt180 -79.74 -10.32 59.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.554 0.216 . . . . 0.0 110.963 175.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.487 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 22.3 t70 -72.09 140.22 48.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.673 -176.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 87.7 mtm-85 -122.95 20.27 10.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.873 0.368 . . . . 0.0 111.274 -177.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.8 p -98.17 5.69 48.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.556 0.693 . . . . 0.0 109.187 172.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.487 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 43.6 mmtm -102.69 159.28 29.81 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.255 175.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.84 108.08 0.85 Allowed 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.262 1.974 . . . . 0.0 112.498 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 89.0 mt -98.63 151.45 20.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.216 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.623 HH21 ' ND2' ' A' ' 88' ' ' ASN . 16.4 ptm180 -96.88 140.52 31.31 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.353 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.633 ' HE2' ' HA ' ' A' ' 87' ' ' LYS . 0.6 OUTLIER -78.07 -28.3 48.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.146 0.498 . . . . 0.0 109.944 -178.289 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.623 ' ND2' HH21 ' A' ' 86' ' ' ARG . 22.9 p-10 -83.26 15.86 2.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.853 178.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.483 ' HB2' ' HG3' ' A' ' 86' ' ' ARG . 38.0 t-105 -62.41 -37.39 85.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.111 175.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.8 -31.6 72.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.939 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.3 m -71.59 -46.63 58.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.199 -178.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.503 ' O ' HG23 ' A' ' 96' ' ' VAL . 34.8 m -92.37 -1.31 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.549 -175.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.596 ' HG2' ' HZ2' ' A' ' 133' ' ' TRP . 80.8 tttt -48.57 -53.2 19.27 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 123.383 0.673 . . . . 0.0 111.292 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -66.83 -40.58 88.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.855 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -62.15 -49.74 74.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.953 -177.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.626 HG22 ' HG2' ' A' ' 54' ' ' GLN . 77.5 t -58.08 -48.98 82.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.895 -178.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 4.4 mmt -59.6 -53.77 54.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.677 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.43 ' HD3' HD22 ' A' ' 148' ' ' LEU . 38.8 ttp85 -69.94 -29.71 66.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.456 -174.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -70.49 -42.29 71.56 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.62 0.248 . . . . 0.0 110.512 178.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.71 -43.98 87.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.094 0.473 . . . . 0.0 110.283 178.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.503 HD13 HD21 ' A' ' 149' ' ' LEU . 76.6 mt -62.38 -42.64 99.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.756 176.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.523 ' HA ' HD21 ' A' ' 152' ' ' LEU . 41.4 ttm180 -56.27 -50.17 72.11 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.159 176.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.81 -37.09 70.7 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 123.487 0.492 . . . . 0.0 111.902 -177.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -68.11 -55.6 11.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.636 0.255 . . . . 0.0 110.816 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.534 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 84.2 m-85 -70.14 -29.69 66.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.917 0.389 . . . . 0.0 111.245 -177.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -67.48 -44.35 78.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.087 0.47 . . . . 0.0 110.595 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -84.68 -31.3 24.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.967 -172.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -108.74 110.83 22.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.263 0.554 . . . . 0.0 111.019 177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.48 -26.43 66.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.531 -177.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -58.94 -49.43 77.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.456 0.646 . . . . 0.0 109.837 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.05 -36.23 66.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.337 -175.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.534 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 1.6 ttp180 -65.34 -39.16 92.03 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.506 177.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.58 -45.07 95.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.979 175.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.557 HD22 ' HB1' ' A' ' 5' ' ' ALA . 61.5 tp -60.78 -47.14 87.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.611 177.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.529 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 53.2 tp -59.31 -50.51 73.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.184 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.511 HD13 ' HG3' ' A' ' 112' ' ' ARG . 9.5 mp -73.55 -11.31 60.4 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.05 -21.19 33.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.589 0.233 . . . . 0.0 111.194 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 77.6 p -82.66 -21.56 34.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.932 0.396 . . . . 0.0 110.861 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.513 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -59.71 141.48 88.82 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.185 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.7 Cg_endo -100.08 41.33 3.83 Favored 'Cis proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.222 -1.158 . . . . 0.0 113.676 1.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.51 165.3 24.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.827 0.346 . . . . 0.0 110.644 177.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.518 ' HB2' HD13 ' A' ' 16' ' ' ILE . 65.8 mttt -94.8 125.34 39.39 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.251 0.548 . . . . 0.0 111.343 -177.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 62.5 mt -86.64 101.35 13.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.185 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 87.0 t -116.1 106.55 20.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.351 -179.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -75.68 119.66 20.0 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 175.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -88.78 77.49 7.83 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.634 0.731 . . . . 0.0 109.153 -176.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.446 ' HB ' ' HA3' ' A' ' 134' ' ' GLY . 22.5 m -96.82 105.64 17.8 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.295 176.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -98.89 -9.23 24.47 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.727 -172.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' A' ' 130' ' ' ASP . 28.2 t-20 -96.52 96.55 8.75 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 129' ' ' ASN . 5.6 m-20 69.69 154.44 0.12 Allowed 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.985 0.803 . . . . 0.0 111.214 -172.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.413 ' HB1' ' HA3' ' A' ' 141' ' ' GLY . . . -99.54 85.6 3.18 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.35 0.595 . . . . 0.0 109.478 173.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.548 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 63.6 t80 -134.97 102.29 5.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.145 -178.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.737 ' HB3' HD22 ' A' ' 145' ' ' LEU . 78.5 m95 63.53 17.6 10.48 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.845 0.716 . . . . 0.0 110.209 -172.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.446 ' HA3' ' HB ' ' A' ' 127' ' ' THR . . . -148.46 155.76 26.56 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.528 ' CG ' ' HB2' ' A' ' 143' ' ' ASN . 2.9 m-20 -88.68 34.44 0.77 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -170.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 59.18 21.33 53.14 Favored Glycine 0 C--O 1.228 -0.28 0 C-N-CA 121.187 -0.53 . . . . 0.0 112.523 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 79.08 -53.11 4.11 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.68 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -67.91 -31.41 71.16 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.646 0.609 . . . . 0.0 112.646 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 119.83 42.15 0.54 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.996 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.5 tttt -172.77 87.32 0.07 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 174.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.413 ' HA3' ' HB1' ' A' ' 131' ' ' ALA . . . -152.74 -64.75 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 119.586 -1.292 . . . . 0.0 113.398 173.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.548 ' HD2' ' HA ' ' A' ' 132' ' ' TYR . 58.0 mttp -164.14 43.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.879 0.34 . . . . 0.0 111.029 -174.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.528 ' HB2' ' CG ' ' A' ' 135' ' ' ASP . 4.0 t-20 -61.1 4.95 0.07 Allowed 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 177.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.559 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 32.2 mtp180 -58.39 -24.13 59.11 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 122.167 -0.333 . . . . 0.0 110.916 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.737 HD22 ' HB3' ' A' ' 133' ' ' TRP . 47.5 tp -61.95 -50.67 71.19 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.006 0.431 . . . . 0.0 110.046 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.633 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -64.75 -32.82 85.47 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.545 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -65.44 -40.92 93.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.807 0.337 . . . . 0.0 110.437 176.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.0 mt -62.12 -38.7 89.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.004 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.503 HD21 HD13 ' A' ' 101' ' ' LEU . 77.8 mt -63.31 -36.93 85.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.82 176.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.633 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 60.8 mtt -61.73 -51.94 66.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.0 0.428 . . . . 0.0 110.128 177.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -63.37 -43.07 98.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.279 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.523 HD21 ' HA ' ' A' ' 102' ' ' ARG . 65.6 tp -61.37 -46.43 90.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.992 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.529 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 29.4 ttp85 -59.16 -39.45 82.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.713 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -65.3 -42.78 92.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.123 0.487 . . . . 0.0 110.106 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -63.59 -39.77 95.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.282 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.507 HD13 ' HD3' ' A' ' 112' ' ' ARG . 67.2 mt -78.9 -12.8 60.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.981 0.419 . . . . 0.0 110.516 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.494 ' HA ' HD21 ' A' ' 116' ' ' LEU . . . -78.66 -33.82 46.79 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.8 173.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.435 ' O ' ' HG3' ' A' ' 162' ' ' GLU . 1.4 mp -56.9 -38.28 58.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.835 177.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -63.42 -34.79 78.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.892 0.377 . . . . 0.0 110.46 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -72.79 -25.27 61.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.695 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.52 -23.72 61.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.878 0.37 . . . . 0.0 110.395 175.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 158' ' ' ILE . 46.0 mt-10 -75.98 9.47 2.42 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.376 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -77.74 -5.71 51.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.967 0.413 . . . . 0.0 110.861 177.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -93.31 122.13 35.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.648 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.433 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 46.5 m80 -94.12 -165.76 1.37 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.677 -176.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.433 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 51.0 m-70 70.15 37.54 1.64 Allowed 'General case' 0 N--CA 1.468 0.437 0 O-C-N 123.478 0.486 . . . . 0.0 111.369 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -157.21 103.66 2.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.819 0.342 . . . . 0.0 110.867 176.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 83.4 t60 . . . . . 0 C--O 1.244 0.813 0 CA-C-O 118.415 -0.803 . . . . 0.0 109.721 178.092 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.3 mmm . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 120.662 0.267 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -79.98 91.84 1.15 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.694 2.263 . . . . 0.0 110.222 173.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.4 t 70.74 138.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.922 -171.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 61.8 mtm-85 -81.6 48.75 1.22 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.573 0.701 . . . . 0.0 110.977 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.449 ' HB1' HD13 ' A' ' 114' ' ' LEU . . . -85.63 -174.29 5.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.483 174.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 59.83 30.92 20.46 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 123.13 0.269 . . . . 0.0 110.883 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -48.03 72.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.133 0.492 . . . . 0.0 109.939 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.4 mt -107.29 124.5 63.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -66.97 -37.27 83.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.942 0.401 . . . . 0.0 111.611 -175.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -154.01 131.67 11.46 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.954 -175.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.8 m -84.98 -178.06 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.06 0.457 . . . . 0.0 110.799 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.4 mtm -100.28 165.83 11.28 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.844 -178.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.99 112.18 3.71 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 175.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 64.84 83.06 0.17 Allowed 'General case' 0 C--N 1.331 -0.231 0 O-C-N 123.943 0.777 . . . . 0.0 110.598 -174.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.475 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 31.7 m -115.12 120.49 39.95 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.398 177.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.423 HG12 ' HB3' ' A' ' 122' ' ' LYS . 31.6 mt -96.98 107.16 19.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.325 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.6 mt -101.64 101.14 11.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.706 -175.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.524 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 38.0 m-80 -87.3 105.02 16.95 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.529 175.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -110.77 166.77 10.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.33 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -150.12 122.9 8.66 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.538 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 81.2 p 56.57 -176.57 0.05 Allowed 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.0 0.92 . . . . 0.0 111.941 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.571 HG22 ' HA ' ' A' ' 28' ' ' ASP . 40.6 p -80.86 -27.84 36.25 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -172.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.5 p 50.98 -90.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.787 0.835 . . . . 0.0 112.045 -177.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -107.56 -93.3 0.4 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -131.95 0.48 3.87 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.018 0.437 . . . . 0.0 110.77 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -101.26 -13.85 17.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.103 0.478 . . . . 0.0 110.986 -176.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.492 ' C ' ' HA ' ' A' ' 22' ' ' THR . . . -94.08 0.24 66.46 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.126 -175.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.571 ' HA ' HG22 ' A' ' 22' ' ' THR . 36.3 m-20 -62.11 0.95 0.35 Allowed 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -174.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -62.3 -31.22 71.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.759 0.314 . . . . 0.0 110.25 171.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 74.7 m -58.48 153.15 16.52 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.511 0.672 . . . . 0.0 112.335 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 47' ' ' SER . 94.5 m-20 -76.85 -16.45 59.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.716 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -86.42 6.28 30.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.031 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.432 ' HB1' ' HD1' ' A' ' 35' ' ' TRP . . . -59.0 146.17 39.17 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.844 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.559 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -91.21 21.1 4.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.683 -173.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.465 ' HE1' ' CG ' ' A' ' 28' ' ' ASP . 77.4 m95 -89.85 124.85 62.67 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-O 120.713 0.292 . . . . 0.0 110.959 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.443 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 36.6 Cg_endo -66.71 128.59 19.26 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.554 2.169 . . . . 0.0 111.931 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.627 HG22 ' HA ' ' A' ' 104' ' ' LYS . 16.0 pt -103.12 137.75 30.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.915 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.466 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 43.4 tptt -100.2 101.18 12.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.057 -178.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.433 ' O ' ' HB3' ' A' ' 40' ' ' ASP . 42.1 t -115.63 125.03 72.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.469 -178.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.433 ' HB3' ' O ' ' A' ' 39' ' ' VAL . 20.6 t70 74.96 -62.67 0.45 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.363 1.078 . . . . 0.0 110.174 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.31 28.69 0.04 OUTLIER Glycine 0 C--N 1.298 -1.53 0 CA-C-N 113.3 -1.773 . . . . 0.0 109.928 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.1 mttp -135.39 142.01 45.6 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -172.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.9 m -102.09 106.42 17.3 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.764 -175.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.479 ' HB2' HG13 ' A' ' 37' ' ' ILE . 49.4 m95 -93.25 122.34 63.4 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.587 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 44' ' ' TRP . 4.4 Cg_endo -48.26 -36.31 29.24 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.698 2.932 . . . . 0.0 114.007 -175.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.559 HG22 ' HA ' ' A' ' 34' ' ' ALA . 55.2 p -148.3 166.22 28.68 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.405 ' HB3' ' O ' ' A' ' 31' ' ' ASN . 22.9 t -63.41 -39.88 95.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.589 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.65 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 5.0 mm-40 -57.64 -37.64 73.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.834 178.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.415 ' CG ' ' HG2' ' A' ' 45' ' ' PRO . 25.7 m80 -60.93 -43.87 98.02 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.551 0.215 . . . . 0.0 111.332 -178.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -68.49 -38.83 81.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.887 0.375 . . . . 0.0 110.683 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -62.71 -45.76 91.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.616 -179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.65 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 53.0 mm-40 -70.06 -33.91 72.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.749 -178.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.34 -44.61 82.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.426 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -81.62 -12.04 58.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.309 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.585 ' HE3' ' HA ' ' A' ' 79' ' ' ARG . 51.1 tttm -65.95 -28.34 68.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.708 175.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.624 ' CE1' ' HB2' ' A' ' 83' ' ' LYS . 96.3 m-85 -110.71 166.5 10.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.182 0.515 . . . . 0.0 111.185 -178.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.627 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.2 pt? -123.25 2.71 9.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.438 175.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -76.27 138.59 40.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.649 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -62.92 -56.15 19.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.562 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -58.84 -47.56 84.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.986 -173.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.488 ' CE2' ' HG3' ' A' ' 83' ' ' LYS . 0.5 OUTLIER -72.67 -41.19 65.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.089 -172.936 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -66.36 -30.97 71.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.433 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.408 ' CD ' HH21 ' A' ' 66' ' ' ARG . 14.1 tp10 -62.93 -47.48 83.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.037 174.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -61.63 -52.59 63.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.413 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.422 HG21 ' HB2' ' A' ' 52' ' ' GLN . 65.1 mt -63.32 -27.73 43.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.682 -175.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.408 HH21 ' CD ' ' A' ' 63' ' ' GLU . 46.4 ttp180 -73.49 -34.08 65.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.762 0.315 . . . . 0.0 111.346 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -99.14 -16.62 18.54 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -173.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.98 127.93 32.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.887 0.375 . . . . 0.0 110.057 178.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 p -85.12 -35.43 21.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.772 0.32 . . . . 0.0 110.935 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.476 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 15.5 m -58.61 116.19 14.33 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.616 -178.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 10.1 Cg_exo -71.99 -44.26 0.97 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.013 2.475 . . . . 0.0 112.529 -178.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.448 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 13.7 tpt -63.55 -42.92 98.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.413 -177.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 64.9 t -65.49 -41.15 90.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.901 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.8 -44.68 90.83 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.312 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.09 -34.81 64.1 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.978 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 72' ' ' MET . 0.7 OUTLIER -65.21 -45.9 82.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.171 -176.825 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -94.14 -2.04 53.3 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.009 0.433 . . . . 0.0 110.423 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.57 -51.26 4.39 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.298 -178.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.585 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 84.5 mtm-85 -82.68 25.3 0.66 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.33 0.586 . . . . 0.0 110.747 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -73.57 157.75 36.11 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.454 174.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 52.2 mtm180 -122.89 8.7 9.36 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.1 m -68.67 -28.04 66.51 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 170.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.624 ' HB2' ' CE1' ' A' ' 56' ' ' PHE . 25.5 mmtm -94.49 154.41 40.19 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.908 177.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.56 171.8 14.65 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.492 2.128 . . . . 0.0 112.791 -177.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 93.8 mt -126.94 173.41 9.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.309 0.576 . . . . 0.0 111.314 -178.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -84.28 152.73 23.98 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.022 177.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -78.89 -29.43 44.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.434 0.635 . . . . 0.0 109.76 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 22.3 p30 -92.18 13.53 18.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.604 176.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.596 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 42.5 t-105 -57.72 -29.58 64.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.55 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.558 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 28.8 mm-40 -63.92 -37.58 87.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.319 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.3 t -90.35 -20.82 22.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.773 0.32 . . . . 0.0 111.837 -174.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.53 ' HA ' ' HB3' ' A' ' 95' ' ' GLN . 34.1 m -101.41 -6.05 9.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -170.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.596 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 57.3 mttp -52.62 -65.02 0.63 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.524 0.678 . . . . 0.0 110.752 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.661 ' OE2' ' HD3' ' A' ' 144' ' ' ARG . 34.9 mt-10 -86.75 -5.06 59.23 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.84 -175.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.53 ' HB3' ' HA ' ' A' ' 92' ' ' VAL . 8.6 tt0 -80.98 -47.36 13.74 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.489 175.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 53.3 t -65.9 -38.21 81.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.35 176.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.761 ' HG3' ' CH2' ' A' ' 133' ' ' TRP . 1.0 OUTLIER -61.81 -43.79 98.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.07 177.655 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -56.46 -44.93 81.0 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.175 0.512 . . . . 0.0 110.304 175.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -62.56 -43.39 98.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.562 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.83 80.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.139 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 97' ' ' MET . 69.2 mt -63.3 -43.57 97.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.585 177.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.45 ' HA ' HD21 ' A' ' 152' ' ' LEU . 76.5 ttt180 -62.79 -42.89 99.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.035 177.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.671 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -59.02 -45.3 91.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.609 177.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.627 ' HA ' HG22 ' A' ' 37' ' ' ILE . 37.2 ttmt -56.38 -58.84 6.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.297 -179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.433 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 91.7 m-85 -80.09 -42.56 23.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -172.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -74.83 -22.51 58.66 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.982 -0.449 . . . . 0.0 111.497 -172.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.671 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.2 OUTLIER -83.5 -37.72 22.72 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.923 176.224 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.413 ' CE1' ' HE3' ' A' ' 35' ' ' TRP . 78.6 m-70 -98.36 104.56 16.61 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.77 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.79 -30.0 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.67 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.438 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.4 mp0 -56.33 -52.04 66.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.543 0.687 . . . . 0.0 110.008 176.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 40.0 mt -78.87 -31.47 45.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.442 -176.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.776 ' HG3' HD13 ' A' ' 156' ' ' LEU . 18.9 ttt180 -63.03 -43.88 97.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.128 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.34 -35.64 78.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.444 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.449 HD13 ' HB1' ' A' ' 5' ' ' ALA . 36.1 tp -64.82 -42.82 94.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.404 178.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.53 HD23 HD12 ' A' ' 156' ' ' LEU . 61.0 tp -62.36 -41.2 98.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.209 0.528 . . . . 0.0 110.726 178.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 87.1 mt -77.7 -14.12 59.7 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.976 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -81.1 -34.61 32.48 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.544 176.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 22.9 p -75.14 -11.92 60.19 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.213 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -57.38 134.59 81.6 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.502 174.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.2 Cg_endo -106.24 69.37 0.23 Allowed 'Cis proline' 0 C--N 1.354 0.817 0 CA-C-N 118.917 0.649 . . . . 0.0 113.112 -5.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -88.85 158.4 18.12 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.423 ' HB3' HG12 ' A' ' 16' ' ' ILE . 20.8 ttmm -88.19 105.95 17.87 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 176.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 29.5 mt -81.09 119.14 23.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.126 -173.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.524 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 47.3 t -134.95 123.6 41.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.9 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -98.85 137.09 37.92 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 172.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.418 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 81.1 t60 -98.91 77.56 2.22 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -177.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 5.7 t -100.01 94.98 6.55 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 122.298 1.047 . . . . 0.0 111.649 -173.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.505 ' HB3' ' HA3' ' A' ' 137' ' ' GLY . 3.0 pt-20 -83.27 14.36 3.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.894 170.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -82.37 -51.92 7.4 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.489 -1.232 . . . . 0.0 108.886 173.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -144.46 108.38 4.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.804 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.3 85.91 4.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.996 0.427 . . . . 0.0 111.182 -177.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.58 ' O ' ' HB3' ' A' ' 142' ' ' LYS . 35.5 t80 -169.17 -28.41 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.659 177.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.776 ' HB3' HD22 ' A' ' 145' ' ' LEU . 47.3 m95 -111.8 77.22 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.529 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 112.39 -140.43 16.23 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 -178.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.403 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 6.2 t0 -86.53 133.02 33.77 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 117.03 0.415 . . . . 0.0 110.222 176.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -84.55 32.33 3.4 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.127 -0.559 . . . . 0.0 112.804 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.505 ' HA3' ' HB3' ' A' ' 128' ' ' GLU . . . 80.95 13.45 81.2 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 121.185 -0.531 . . . . 0.0 114.091 174.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -154.35 12.15 0.41 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.955 0.877 . . . . 0.0 112.744 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 98.86 5.37 56.55 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 121.042 -0.599 . . . . 0.0 114.096 172.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -167.32 97.27 0.5 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 117.257 0.529 . . . . 0.0 111.253 176.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.33 -64.91 0.2 Allowed Glycine 0 C--N 1.31 -0.863 0 C-N-CA 120.481 -0.866 . . . . 0.0 111.332 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 132' ' ' TYR . 37.6 tttm -177.96 83.86 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.27 5.28 0.57 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.187 -174.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.661 ' HD3' ' OE2' ' A' ' 94' ' ' GLU . 51.2 ttt180 -62.48 -24.13 67.3 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -175.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.776 HD22 ' HB3' ' A' ' 133' ' ' TRP . 31.1 tp -58.57 -50.77 72.6 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 175.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.585 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -66.52 -28.62 73.84 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.925 176.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -68.78 -38.7 80.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.755 0.312 . . . . 0.0 110.328 177.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 96.3 mt -61.16 -37.55 83.28 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 174.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 153' ' ' ARG . 96.0 mt -64.9 -37.88 89.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.511 176.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.585 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 58.2 mtt -63.0 -51.77 65.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.875 0.369 . . . . 0.0 110.166 176.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -59.11 -44.41 91.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.459 -178.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 55.7 tp -67.11 -40.24 86.83 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.009 178.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.828 HH11 ' HB3' ' A' ' 153' ' ' ARG . 1.4 ttp-105 -57.8 -43.56 85.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.465 -179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.18 -46.42 82.84 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.278 175.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.0 -51.39 69.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.518 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.776 HD13 ' HG3' ' A' ' 112' ' ' ARG . 20.9 mt -63.33 -30.78 71.85 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.909 -175.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -69.0 -48.15 63.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.324 175.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.552 ' O ' ' HG3' ' A' ' 162' ' ' GLU . 81.7 mt -64.01 -39.05 84.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.202 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -56.11 -47.21 78.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.978 0.418 . . . . 0.0 110.552 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -84.05 -15.95 45.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.117 0.484 . . . . 0.0 110.418 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 14.4 tp -72.38 -19.06 61.68 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 175.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.552 ' HG3' ' O ' ' A' ' 158' ' ' ILE . 42.0 mt-10 -74.64 10.83 1.2 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.998 176.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -57.69 94.83 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.57 0.7 . . . . 0.0 111.591 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -114.87 90.67 3.4 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.308 0.575 . . . . 0.0 110.888 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 63.74 12.06 6.34 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.401 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 22.8 t-160 -63.2 -42.69 99.35 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 176.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -137.95 -38.84 0.56 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 168.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 . . . . . 0 C--O 1.247 0.968 0 CA-C-N 114.637 -1.165 . . . . 0.0 108.521 177.544 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.402 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 63.6 mtt . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.567 -0.16 . . . . 0.0 110.567 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 1' ' ' MET . 17.4 Cg_exo -66.6 -44.85 5.52 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.226 1.951 . . . . 0.0 110.141 171.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 20.4 t -103.6 100.97 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.68 173.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -87.39 101.03 13.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.887 0.375 . . . . 0.0 111.013 -173.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.78 124.88 30.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.263 177.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -149.96 149.91 31.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.755 0.312 . . . . 0.0 110.362 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.422 ' HE ' ' HB2' ' A' ' 7' ' ' ARG . 17.4 mtm180 -89.7 121.45 31.88 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.091 -175.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.9 tt -98.66 114.25 35.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.48 0.657 . . . . 0.0 109.318 169.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.13 168.51 16.68 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.856 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.1 m170 59.55 59.68 2.51 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -173.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.429 HG21 ' HD2' ' A' ' 120' ' ' PRO . 29.1 m -83.46 15.27 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.727 -173.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 38.5 mtm 63.94 40.9 6.98 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.537 171.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 70.43 -69.4 0.18 Allowed 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.709 0.631 . . . . 0.0 111.733 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -140.18 87.78 2.17 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.61 -174.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.4 t -101.65 142.08 33.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.119 176.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.422 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.0 mp -96.15 105.61 17.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.4 mt -89.85 115.26 29.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.034 0.445 . . . . 0.0 110.347 -175.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.461 HD22 ' N ' ' A' ' 18' ' ' ASN . 0.9 OUTLIER -93.93 108.68 20.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.43 -177.22 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 31.4 p90 -114.25 113.79 25.09 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.086 0.47 . . . . 0.0 110.394 177.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.512 ' O ' ' HB2' ' A' ' 21' ' ' SER . 16.9 t80 -150.17 100.22 2.88 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 174.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 33.8 t 161.34 115.58 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.23 0 O-C-N 124.205 0.941 . . . . 0.0 109.008 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 m -87.94 2.47 51.56 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.241 0.543 . . . . 0.0 110.245 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.9 m -110.1 20.03 18.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.05 -177.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -126.29 157.63 37.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.966 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.91 -33.06 74.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.868 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -87.62 -1.52 58.01 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.6 0.714 . . . . 0.0 109.86 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.25 -0.29 56.61 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.261 -177.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -51.69 -30.74 23.28 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -72.9 -0.79 14.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.734 0.302 . . . . 0.0 111.701 -177.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.9 t -75.06 139.78 43.05 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -77.63 -3.2 39.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.004 0.431 . . . . 0.0 110.573 178.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -106.77 12.01 29.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.37 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.2 137.14 57.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.855 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.94 58.18 2.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.297 0.57 . . . . 0.0 111.595 -174.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.417 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . 95.9 m95 -112.0 118.81 45.62 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.966 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 35' ' ' TRP . 36.9 Cg_endo -66.78 134.53 35.2 Favored 'Trans proline' 0 C--O 1.239 0.534 0 C-N-CA 122.624 2.216 . . . . 0.0 111.501 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.548 HG22 ' HA ' ' A' ' 104' ' ' LYS . 29.8 pt -121.85 155.84 26.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.101 0.477 . . . . 0.0 110.925 -176.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.596 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 1.2 tmtp? -117.31 107.07 13.95 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 -178.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.4 ' C ' ' H ' ' A' ' 41' ' ' GLY . 7.7 t -127.21 127.88 69.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.072 -173.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 27.6 t70 73.64 -19.94 0.32 Allowed 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.712 0.633 . . . . 0.0 111.84 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.539 ' HA2' ' HE2' ' A' ' 38' ' ' LYS . . . 125.79 1.86 7.47 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 -171.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -109.52 134.98 51.25 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.241 -0.48 . . . . 0.0 110.1 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.3 m -84.17 116.5 22.95 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.167 176.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.48 ' HB2' HG13 ' A' ' 37' ' ' ILE . 80.0 m95 -106.06 130.74 22.51 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.837 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.65 -26.16 69.02 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.695 2.263 . . . . 0.0 112.945 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.81 ' HB ' ' OE1' ' A' ' 48' ' ' GLU . 0.1 OUTLIER -159.71 173.7 15.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.329 -178.044 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.0 m -77.87 -48.34 16.65 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -171.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.81 ' OE1' ' HB ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -59.94 -25.97 65.59 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.178 -178.844 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.493 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 54.3 m80 -59.82 -43.4 94.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.005 176.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -67.22 -44.69 78.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.945 0.402 . . . . 0.0 110.074 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -60.87 -46.59 90.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.638 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.47 ' CG ' ' HA3' ' A' ' 78' ' ' GLY . 2.4 tp-100 -65.08 -32.4 74.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.809 -177.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.408 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -73.74 -46.06 48.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.53 -178.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -77.83 -9.54 59.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.181 0.515 . . . . 0.0 110.756 -177.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.413 ' HA ' ' CZ3' ' A' ' 89' ' ' TRP . 86.8 tttt -63.43 -29.17 70.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.045 175.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -109.17 167.09 10.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.78 -177.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.444 HD11 ' HG2' ' A' ' 86' ' ' ARG . 5.2 mp -96.57 -37.19 10.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.934 -176.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.556 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 24.5 t70 -63.38 126.63 28.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.822 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.63 -32.37 67.88 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -173.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.8 ttpp -64.35 -40.9 96.77 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.479 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 0.5 OUTLIER -66.45 -32.25 73.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.712 -179.628 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.556 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 65.0 mtt180 -63.67 -45.2 91.21 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.368 0.604 . . . . 0.0 109.556 176.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -77.59 -16.36 58.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.386 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.479 ' HB2' ' HA ' ' A' ' 61' ' ' TYR . 6.3 tp10 -66.82 -45.81 77.13 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.53 ' O ' HG12 ' A' ' 68' ' ' VAL . 1.9 mp -70.79 -31.4 45.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.731 175.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.4 ' HG2' ' O ' ' A' ' 66' ' ' ARG . 70.8 ttt180 -72.57 -11.54 60.69 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.009 0.433 . . . . 0.0 110.644 175.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -85.24 -7.95 58.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.132 0.491 . . . . 0.0 110.402 -177.901 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.56 HG21 ' HB ' ' A' ' 73' ' ' VAL . 7.5 p -115.36 138.43 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.792 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 39.3 t -90.35 -32.41 16.48 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.798 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.457 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 31.4 t -68.71 121.41 81.06 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.708 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.493 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 22.4 Cg_exo -66.05 -32.83 43.15 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.121 2.547 . . . . 0.0 112.26 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 46.3 ttm -67.8 -41.44 83.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.696 -177.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.56 ' HB ' HG21 ' A' ' 68' ' ' VAL . 87.1 t -66.3 -36.2 76.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.447 178.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.43 -44.28 95.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.247 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.417 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -63.44 -39.43 94.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.73 177.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -56.51 -53.84 52.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.693 178.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 54.0 mtm -70.56 -30.54 67.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.914 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.47 ' HA3' ' CG ' ' A' ' 52' ' ' GLN . . . -81.95 -7.22 88.19 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.943 -178.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 40.9 ttt180 -89.24 -0.94 57.85 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 122.539 -0.389 . . . . 0.0 110.627 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.443 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 30.2 t70 -71.12 112.38 7.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.047 0.451 . . . . 0.0 110.499 -179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -96.16 10.82 36.5 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.325 0.583 . . . . 0.0 110.16 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 m -74.13 -24.4 59.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.643 176.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.443 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 49.2 mmtm -75.78 147.0 80.62 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.576 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -62.51 120.58 8.18 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.319 2.013 . . . . 0.0 111.215 173.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 89.4 mt -86.74 150.95 23.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.804 -176.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.572 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 22.7 mtp180 -68.83 130.63 43.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.36 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -58.06 -43.09 86.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.976 0.417 . . . . 0.0 111.603 -177.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -103.32 33.23 3.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.835 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.572 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 43.8 t-105 -60.09 -40.11 88.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.776 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.477 ' HA ' ' HE3' ' A' ' 93' ' ' LYS . 12.4 pt-20 -68.23 -23.38 64.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.697 0.284 . . . . 0.0 111.211 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.0 m -84.38 -20.15 32.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.15 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.6 m -114.3 6.99 7.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 110.607 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.477 ' HE3' ' HA ' ' A' ' 90' ' ' GLU . 38.4 ttmt -58.78 -53.01 63.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.649 -176.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -25.5 49.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.469 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.823 ' HA ' ' HD2' ' A' ' 98' ' ' ARG . 34.0 tt0 -58.68 -56.06 27.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.631 174.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.9 -43.99 96.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.823 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 47.0 ttm -65.05 -43.92 90.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.774 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.823 ' HD2' ' HA ' ' A' ' 95' ' ' GLN . 0.8 OUTLIER -66.65 -29.32 69.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.441 -178.535 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.446 ' N ' ' HG2' ' A' ' 98' ' ' ARG . 88.3 tttt -71.12 -42.79 68.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.021 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.62 87.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.428 176.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.407 ' HA ' HD23 ' A' ' 101' ' ' LEU . 22.4 mt -60.91 -41.76 96.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.227 178.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.705 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 58.4 ttt180 -61.01 -48.65 80.83 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 120.383 -0.527 . . . . 0.0 109.882 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -55.9 -36.69 67.94 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.115 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.548 ' HA ' HG22 ' A' ' 37' ' ' ILE . 63.5 tttm -59.21 -50.61 73.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.171 178.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -81.79 -26.21 34.6 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -177.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.705 ' HG3' ' HG2' ' A' ' 102' ' ' ARG . 5.9 mm-40 -74.98 -35.79 62.04 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.729 0.3 . . . . 0.0 111.759 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.596 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 77.2 mm-40 -84.21 -11.46 56.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.985 0.422 . . . . 0.0 110.905 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -129.2 99.21 5.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.811 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -59.67 -29.9 68.39 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.486 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.9 mp0 -53.26 -51.79 61.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.074 175.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 29.0 mt -75.42 -33.7 60.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.48 -176.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 24.6 ttt-85 -57.96 -41.77 83.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.114 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.7 -43.12 73.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.792 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 63.7 tp -57.11 -44.28 83.11 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.784 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.441 HD23 HD12 ' A' ' 156' ' ' LEU . 40.5 tp -62.76 -45.89 90.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.274 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 156' ' ' LEU . 79.0 mt -70.37 -18.28 63.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.719 0.295 . . . . 0.0 111.629 -176.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -73.9 -21.9 59.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.631 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.1 p -75.67 -27.28 58.26 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -176.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.518 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -48.78 137.78 12.76 Favored Pre-proline 0 N--CA 1.467 0.379 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.429 ' HD2' HG21 ' A' ' 11' ' ' VAL . 94.5 Cg_endo -100.75 33.74 8.3 Favored 'Cis proline' 0 N--CA 1.458 -0.588 0 C-N-CA 124.554 -1.019 . . . . 0.0 112.941 -2.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -62.84 159.42 16.65 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.976 0.417 . . . . 0.0 111.688 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -90.5 119.05 30.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.114 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.416 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 60.5 mt -86.4 113.48 22.39 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.757 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 95.7 t -131.9 126.8 57.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.084 0.469 . . . . 0.0 111.285 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.568 ' OE1' ' HA3' ' A' ' 134' ' ' GLY . 0.0 OUTLIER -83.31 141.73 31.6 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 172.777 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -120.04 77.51 1.25 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.374 -174.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 2.2 m -78.33 137.49 38.08 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.601 171.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 45.6 mp0 -120.49 -1.36 10.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.74 0.305 . . . . 0.0 110.658 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -94.57 -5.43 45.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.885 0.374 . . . . 0.0 111.297 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.791 ' O ' ' HA2' ' A' ' 136' ' ' GLY . 4.8 t70 -178.48 -165.01 0.08 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.06 86.2 2.23 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.88 0.371 . . . . 0.0 110.133 175.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.549 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 4.7 t80 -155.13 122.29 5.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.584 -175.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.433 ' HZ2' ' HG2' ' A' ' 93' ' ' LYS . 28.8 m95 64.03 20.62 12.28 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.78 0.675 . . . . 0.0 112.513 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.568 ' HA3' ' OE1' ' A' ' 125' ' ' GLU . . . -176.01 -114.85 0.39 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.232 -0.985 . . . . 0.0 112.279 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -112.79 173.14 6.52 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 120.698 0.285 . . . . 0.0 110.794 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.791 ' HA2' ' O ' ' A' ' 130' ' ' ASP . . . -120.95 21.11 8.42 Favored Glycine 0 N--CA 1.444 -0.821 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 175.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.6 44.12 4.99 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.425 -0.417 . . . . 0.0 113.26 178.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -174.15 -35.34 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 117.164 0.482 . . . . 0.0 112.207 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 131.01 36.41 0.35 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.893 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt 179.32 89.99 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.816 0.341 . . . . 0.0 110.804 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.589 ' O ' ' HG3' ' A' ' 142' ' ' LYS . . . -123.93 -65.13 0.2 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 119.664 -1.255 . . . . 0.0 112.124 174.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.589 ' HG3' ' O ' ' A' ' 141' ' ' GLY . 47.6 mttp -166.17 79.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 123.697 0.799 . . . . 0.0 109.2 177.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.1 4.99 2.32 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.511 -173.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.692 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 6.9 tpp180 -49.63 -38.64 32.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.226 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.56 -58.5 7.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.962 -178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.416 ' HA3' ' O ' ' A' ' 123' ' ' LEU . . . -62.49 -29.88 74.8 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.945 -0.645 . . . . 0.0 111.752 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . 0.437 ' O ' ' HG2' ' A' ' 151' ' ' GLU . 11.4 t80 -67.21 -40.67 86.45 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.1 mt -61.06 -41.49 96.7 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.895 0.379 . . . . 0.0 110.174 175.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.8 mt -61.15 -36.76 80.64 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.863 177.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 77.8 mtm -77.58 -34.78 53.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.972 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 147' ' ' TYR . 7.3 mm-40 -59.72 -48.26 82.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.457 0.646 . . . . 0.0 109.48 172.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.522 HD11 ' HG3' ' A' ' 102' ' ' ARG . 54.3 tp -64.56 -37.63 88.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.793 179.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.674 ' HG2' HH11 ' A' ' 153' ' ' ARG . 30.9 ttp85 -61.04 -41.34 96.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.988 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -67.28 -33.95 76.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.084 0.468 . . . . 0.0 110.461 176.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -65.32 -53.18 47.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.901 177.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.533 ' HB2' HD21 ' A' ' 116' ' ' LEU . 55.2 mt -68.0 -23.59 65.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.93 -175.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.518 ' O ' ' HB3' ' A' ' 160' ' ' LYS . . . -64.43 -48.81 73.92 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.494 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.08 -37.42 80.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.771 0.319 . . . . 0.0 110.616 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.69 -24.19 66.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.019 0.438 . . . . 0.0 110.725 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' A' ' 157' ' ' ALA . 53.3 tttp -68.1 -26.73 65.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.257 176.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.4 mp -78.64 -35.69 45.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.248 0.547 . . . . 0.0 109.935 176.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -84.43 11.54 8.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.435 -178.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 4.8 p80 -62.75 -15.99 55.78 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.737 0.303 . . . . 0.0 110.932 -178.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -60.84 112.1 1.91 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.22 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.664 ' HD2' ' HB3' ' A' ' 168' ' ' HIS . 10.0 t-160 59.94 24.16 13.27 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.06 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 27.9 t60 -76.19 -25.58 55.33 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 63.7 t-80 -147.03 93.26 2.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.462 172.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.664 ' HB3' ' HD2' ' A' ' 165' ' ' HIS . 36.7 t60 . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.727 -0.654 . . . . 0.0 109.357 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 120.736 0.303 . . . . 0.0 110.479 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -87.6 150.1 7.51 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 122.821 2.348 . . . . 0.0 113.202 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.7 p -167.17 94.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.902 0.858 . . . . 0.0 109.988 175.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.527 ' HB3' ' CG ' ' A' ' 25' ' ' ASP . 42.3 ttm105 -105.6 37.89 2.12 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.772 0.796 . . . . 0.0 110.195 -176.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.419 ' HB1' HD13 ' A' ' 114' ' ' LEU . . . -78.37 29.4 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.2 -176.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -122.55 25.47 8.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.785 0.326 . . . . 0.0 110.789 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -75.02 -52.88 9.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.516 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 68.5 mt -105.55 111.27 34.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.437 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -89.49 85.81 6.61 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.691 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 65.23 118.12 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.332 0.587 . . . . 0.0 111.588 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.518 HG21 ' HB2' ' A' ' 121' ' ' ALA . 34.4 m -68.59 163.14 3.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.542 176.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.428 ' SD ' ' N ' ' A' ' 12' ' ' MET . 0.0 OUTLIER -81.2 -79.9 0.15 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.814 -173.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.0 tp60 -171.46 119.74 0.47 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.391 -0.822 . . . . 0.0 108.925 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.8 t70 59.58 88.11 0.08 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.596 0.713 . . . . 0.0 110.198 -172.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.54 ' O ' ' HB1' ' A' ' 121' ' ' ALA . 9.2 m -134.44 117.02 15.82 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.582 -179.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.465 ' H ' HD12 ' A' ' 16' ' ' ILE . 4.2 mp -82.95 100.77 6.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.469 HD11 HG11 ' A' ' 11' ' ' VAL . 62.9 mt -89.81 108.75 19.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.266 -177.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.616 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 0.9 OUTLIER -92.81 106.64 18.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.598 179.436 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.648 ' CE2' ' HB2' ' A' ' 125' ' ' GLU . 39.6 p90 -105.02 151.33 24.08 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 174.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.671 ' CE1' ' HA ' ' A' ' 127' ' ' THR . 1.7 t80 -150.1 108.04 3.72 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.436 -0.505 . . . . 0.0 111.923 -176.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.7 m 73.68 171.14 0.3 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.614 0.721 . . . . 0.0 112.247 173.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.0 p -82.43 3.05 29.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.997 -1.001 . . . . 0.0 112.222 -172.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.7 p -76.12 23.39 0.14 Allowed 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -174.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -156.92 163.66 38.9 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 -178.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.527 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 5.7 m-20 -61.24 -35.71 77.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.264 0.554 . . . . 0.0 109.901 175.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.426 ' CE1' HD11 ' A' ' 114' ' ' LEU . 92.2 m-85 -77.74 -1.95 33.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.354 177.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.27 -4.15 67.8 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.08 177.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -68.78 -22.85 64.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.423 0.63 . . . . 0.0 110.093 174.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -68.5 -24.86 64.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.475 176.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.0 m -71.98 134.11 45.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.739 175.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -54.97 -23.63 20.14 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -174.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.62 -52.96 17.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 176.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 42.25 -157.2 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.863 0.865 . . . . 0.0 112.992 -176.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -157.86 22.63 0.27 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.737 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.422 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 84.1 m95 -112.99 125.58 29.58 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.935 -177.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 24.5 Cg_exo -64.38 143.24 82.04 Favored 'Trans proline' 0 C--O 1.238 0.485 0 C-N-CA 122.844 2.363 . . . . 0.0 112.41 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.652 HG22 ' HA ' ' A' ' 104' ' ' LYS . 32.2 pt -121.92 153.0 25.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.523 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.414 ' HE3' ' O ' ' A' ' 41' ' ' GLY . 37.9 tptt -116.17 95.43 5.08 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 t -107.81 117.42 53.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.291 -178.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.6 t70 69.13 5.01 4.84 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.584 0.707 . . . . 0.0 110.632 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.414 ' O ' ' HE3' ' A' ' 38' ' ' LYS . . . 104.67 -2.34 42.18 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.469 -175.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 51.6 mttm -94.25 125.45 38.89 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.66 ' HB ' HH21 ' A' ' 66' ' ' ARG . 35.2 m -82.82 109.72 17.21 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.863 0.363 . . . . 0.0 110.602 178.073 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.436 ' HB2' ' CG1' ' A' ' 37' ' ' ILE . 57.6 m95 -101.84 129.04 27.37 Favored Pre-proline 0 C--N 1.318 -0.773 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 174.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.472 ' CG ' ' HA ' ' A' ' 69' ' ' SER . 52.4 Cg_exo -53.78 -22.57 23.77 Favored 'Trans proline' 0 N--CA 1.475 0.431 0 C-N-CA 123.026 2.484 . . . . 0.0 113.338 -176.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 15.4 t -179.31 173.37 1.12 Allowed 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 175.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.73 -32.57 71.83 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -175.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -50.02 -43.37 50.68 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.559 0.343 . . . . 0.0 111.335 175.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -69.13 -30.13 68.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.168 -175.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -76.02 -31.65 59.0 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -64.02 -52.38 59.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.948 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -63.6 -41.03 98.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.653 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.784 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -67.04 -27.69 67.61 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -100.49 -7.15 24.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.657 0.265 . . . . 0.0 110.988 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.545 ' HA ' ' CZ3' ' A' ' 89' ' ' TRP . 83.2 tttt -62.62 -39.59 94.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.333 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -107.36 160.79 15.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.115 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.754 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.6 pt? -95.73 28.9 2.84 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 168.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -97.68 106.58 18.91 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.105 -1.407 . . . . 0.0 109.895 -176.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 2.4 mp0 -64.69 -35.8 82.2 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.346 -178.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -63.79 -47.6 80.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.797 0.332 . . . . 0.0 110.809 -177.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.552 ' O ' HG12 ' A' ' 65' ' ' ILE . 0.1 OUTLIER -68.77 -29.55 67.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.367 -178.145 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.784 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 38.4 ttm180 -60.99 -41.9 97.38 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.127 0.489 . . . . 0.0 109.754 176.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 45.0 mt-10 -65.7 -39.51 91.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.117 176.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.26 -36.99 63.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.154 -174.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 61' ' ' TYR . 41.1 mm -63.56 -33.47 61.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 174.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.66 HH21 ' HB ' ' A' ' 43' ' ' THR . 0.4 OUTLIER -73.25 -25.31 60.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.271 178.04 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 58.0 mtt-85 -70.28 -33.24 71.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.643 0.259 . . . . 0.0 111.204 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.4 m -92.29 134.88 29.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.239 0.542 . . . . 0.0 111.417 -175.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.472 ' HA ' ' CG ' ' A' ' 45' ' ' PRO . 5.0 p -88.78 -21.32 23.85 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.479 175.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 44.5 t -78.47 126.18 83.42 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.741 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -72.34 -32.29 10.46 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.636 2.224 . . . . 0.0 112.008 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.9 tpt -69.82 -38.36 76.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.266 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 95.5 t -68.32 -39.09 80.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.565 177.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.98 -52.2 57.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.658 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.14 -35.77 74.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.044 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 30.5 ttt85 -62.33 -39.98 94.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.742 0.306 . . . . 0.0 110.689 177.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 72.4 mtm -74.02 -34.93 64.32 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.03 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.49 6.37 77.74 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.469 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -63.25 -42.3 99.16 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -86.95 176.9 7.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.831 0.348 . . . . 0.0 111.482 -170.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -115.18 5.42 14.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.046 -174.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 49.9 m -64.75 -27.3 68.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.884 0.373 . . . . 0.0 111.294 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.498 ' HE3' ' CE2' ' A' ' 61' ' ' TYR . 0.2 OUTLIER -89.49 147.22 37.48 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -50.27 112.55 0.76 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.164 2.576 . . . . 0.0 113.97 -173.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 97.0 mt -88.47 155.17 19.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.023 175.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 -95.76 143.77 26.71 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.747 0.308 . . . . 0.0 110.497 -178.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -79.45 -28.64 41.62 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.177 0.513 . . . . 0.0 110.28 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -85.47 11.9 9.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.621 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.545 ' CZ3' ' HA ' ' A' ' 55' ' ' LYS . 60.7 t-105 -60.39 -19.45 55.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.333 0.587 . . . . 0.0 110.138 176.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.612 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 17.9 mm-40 -68.11 -40.38 82.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.488 175.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.0 p -100.02 -1.0 38.12 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -172.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.484 HG22 ' HA ' ' A' ' 89' ' ' TRP . 34.7 m -112.37 0.8 8.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -177.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.612 ' NZ ' ' HA ' ' A' ' 90' ' ' GLU . 50.7 mttp -61.04 -54.92 38.83 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.286 0.565 . . . . 0.0 109.944 179.497 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -67.74 -28.66 67.83 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.471 -178.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -69.94 -54.09 14.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.744 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.4 t -62.22 -43.99 98.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.636 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.09 -50.15 74.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.886 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.5 ttm-85 -60.01 -43.11 95.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.899 0.381 . . . . 0.0 110.866 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -66.48 -48.01 71.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.919 -178.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.11 -37.98 89.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.88 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.425 HD13 ' CD2' ' A' ' 149' ' ' LEU . 90.0 mt -67.5 -43.06 81.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.107 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.522 ' HG3' HD11 ' A' ' 152' ' ' LEU . 10.9 ttt-85 -61.55 -46.55 89.46 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.956 178.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -63.91 -24.48 67.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.097 -179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.652 ' HA ' HG22 ' A' ' 37' ' ' ILE . 28.1 ttpp -76.74 -49.6 15.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.547 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.595 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 77.4 m-85 -71.6 -27.55 63.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.327 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.431 ' HA ' HH11 ' A' ' 112' ' ' ARG . 25.6 mt-10 -73.83 -35.4 64.84 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.613 173.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.538 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 7.8 tp-100 -66.81 -34.66 78.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.061 -177.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.447 ' HB3' ' OE2' ' A' ' 110' ' ' GLU . 97.0 m-70 -121.4 109.59 15.06 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.459 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.76 -33.25 73.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.778 -177.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.0 OUTLIER -72.44 -29.9 64.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.77 -179.044 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 76.2 mt -74.61 -38.64 62.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.04 0.447 . . . . 0.0 109.893 175.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.595 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 30.6 ttp-105 -62.89 -43.53 98.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.045 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.69 72.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.722 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.426 HD11 ' CE1' ' A' ' 26' ' ' TYR . 66.4 tp -66.27 -48.17 71.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.943 0.401 . . . . 0.0 110.257 176.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.495 HD23 HD12 ' A' ' 156' ' ' LEU . 42.7 tp -59.41 -44.89 92.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.013 178.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 51.3 mt -74.94 -15.96 60.66 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.476 -177.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.3 -21.14 56.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.894 0.378 . . . . 0.0 110.752 176.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.417 ' O ' ' HB3' ' A' ' 121' ' ' ALA . 43.8 p -85.97 -5.95 59.13 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 121.05 0.453 . . . . 0.0 110.559 178.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.07 143.21 65.3 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.282 174.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -99.34 46.56 2.36 Favored 'Cis proline' 0 N--CA 1.456 -0.687 0 C-N-CA 124.397 -1.085 . . . . 0.0 113.56 -0.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.54 ' HB1' ' O ' ' A' ' 15' ' ' THR . . . -78.73 176.53 9.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.588 0.232 . . . . 0.0 110.761 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.413 ' HG3' ' SD ' ' A' ' 150' ' ' MET . 35.1 ttpt -108.69 127.82 54.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.271 -176.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 27.8 mt -93.16 120.46 33.48 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.27 -172.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 99.0 t -139.42 120.3 15.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.047 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.648 ' HB2' ' CE2' ' A' ' 19' ' ' PHE . 31.8 tt0 -93.88 129.86 40.15 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 172.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.501 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 8.4 t60 -97.63 77.6 2.58 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -176.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.671 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -77.17 92.22 3.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.065 -179.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.421 ' HB2' ' HD2' ' A' ' 126' ' ' HIS . 20.3 tt0 -95.53 -15.01 23.16 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.225 -174.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -88.61 -34.08 17.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.542 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.543 ' O ' ' HB ' ' A' ' 127' ' ' THR . 34.3 t70 -142.19 110.28 5.93 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.101 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.524 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -79.09 85.94 4.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.919 -172.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.518 ' CE2' ' HD3' ' A' ' 142' ' ' LYS . 7.4 t80 -169.55 147.36 3.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.522 172.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.456 ' HB3' HD22 ' A' ' 145' ' ' LEU . 18.5 m95 68.53 13.6 8.97 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 123.746 0.654 . . . . 0.0 111.693 178.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -160.44 -155.59 7.83 Favored Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 119.929 -1.129 . . . . 0.0 112.71 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.501 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 15.3 t70 -66.43 -29.02 69.07 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.224 0.535 . . . . 0.0 110.696 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.638 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 78.06 0.41 76.2 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.62 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.441 ' HA2' ' NE2' ' A' ' 126' ' ' HIS . . . 88.26 9.37 70.13 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.491 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -170.3 25.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 111.186 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 86.54 -51.97 4.41 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.288 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -88.67 65.25 7.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.3 0.572 . . . . 0.0 111.119 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.638 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -123.32 14.49 8.25 Favored Glycine 0 C--N 1.315 -0.616 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.379 173.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.518 ' HD3' ' CE2' ' A' ' 132' ' ' TYR . 22.2 mtpp 61.36 79.9 0.24 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.211 0.604 . . . . 0.0 111.071 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -75.38 5.33 5.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.276 -176.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.668 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 1.2 ttm180 -32.76 -37.42 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.43 1.092 . . . . 0.0 112.665 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.456 HD22 ' HB3' ' A' ' 133' ' ' TRP . 45.4 tp -61.37 -52.65 63.76 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.611 0.243 . . . . 0.0 111.126 -178.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -63.17 -27.01 69.88 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.701 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -71.33 -43.34 67.2 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.668 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 75.1 mt -61.71 -41.21 97.3 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 175.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.425 ' CD2' HD13 ' A' ' 101' ' ' LEU . 60.8 mt -61.3 -38.83 88.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.813 175.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.413 ' SD ' ' HG3' ' A' ' 122' ' ' LYS . 62.4 mtm -70.09 -38.95 75.82 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.212 178.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.0 -46.13 90.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.026 0.441 . . . . 0.0 109.887 174.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.522 HD11 ' HG3' ' A' ' 102' ' ' ARG . 45.7 tp -63.29 -42.06 99.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.642 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.938 HH11 ' HB3' ' A' ' 153' ' ' ARG . 1.0 OUTLIER -60.01 -42.49 94.39 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.672 176.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.63 -44.68 93.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.226 0.536 . . . . 0.0 109.858 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -65.12 -41.42 94.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.143 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.495 HD12 HD23 ' A' ' 115' ' ' LEU . 79.3 mt -76.28 -22.57 54.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.706 -0.225 . . . . 0.0 110.569 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -67.24 -44.37 79.63 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 172.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 75.2 mt -63.6 -40.12 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.876 174.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -63.52 -32.42 73.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.217 177.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.455 ' O ' ' HD2' ' A' ' 163' ' ' HIS . 27.7 tptp -74.58 -44.07 52.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.795 176.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.12 -16.93 49.68 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.641 175.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.418 ' O ' ' N ' ' A' ' 164' ' ' HIS . 0.7 OUTLIER -79.1 11.61 2.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.544 177.319 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.455 ' HD2' ' O ' ' A' ' 160' ' ' LYS . 22.9 p80 -54.4 76.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.72 0.771 . . . . 0.0 111.547 171.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . 0.418 ' N ' ' O ' ' A' ' 162' ' ' GLU . 31.9 m80 -147.64 173.83 12.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.066 -178.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -105.62 76.14 1.18 Allowed 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 159.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -52.67 -47.8 66.94 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.04 -1.436 . . . . 0.0 111.596 -169.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -137.81 -29.81 0.84 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.504 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 74.6 t60 . . . . . 0 C--O 1.245 0.862 0 CA-C-O 118.353 -0.832 . . . . 0.0 109.957 178.398 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.4 tpp . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -76.53 19.25 0.65 Allowed 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.938 1.759 . . . . 0.0 113.166 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.466 HG21 ' HB3' ' A' ' 110' ' ' GLU . 8.4 p 43.69 89.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 124.714 1.206 . . . . 0.0 113.187 178.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -101.66 -31.91 10.58 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.889 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 56.0 68.79 0.81 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.513 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -68.06 127.24 32.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.432 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.5 mtm-85 -98.7 141.13 31.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.547 -172.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.615 HD12 ' HA ' ' A' ' 118' ' ' THR . 64.5 mt -77.66 135.29 26.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.205 178.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -84.39 -48.22 9.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.104 0.478 . . . . 0.0 110.759 -178.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -141.66 116.6 9.88 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.523 -176.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.801 HG21 ' HD2' ' A' ' 120' ' ' PRO . 9.0 m -89.65 163.83 2.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 21.0 mtm -125.26 18.19 8.31 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.594 0.235 . . . . 0.0 110.791 -174.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.401 ' C ' ' H ' ' A' ' 15' ' ' THR . 27.1 mt-30 69.18 -60.21 0.46 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.168 -176.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -79.23 24.33 0.34 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.705 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.401 ' H ' ' C ' ' A' ' 13' ' ' GLN . 11.8 m -83.13 103.25 12.4 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.311 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.556 HG12 ' HB3' ' A' ' 122' ' ' LYS . 28.4 mt -100.88 108.73 23.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 175.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -92.35 111.6 24.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.413 -174.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.63 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 16.8 m120 -99.61 116.46 31.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.076 -178.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.455 ' O ' ' HG3' ' A' ' 125' ' ' GLU . 28.8 p90 -112.36 174.44 5.88 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.238 178.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -142.16 100.57 3.75 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.7 p 49.17 -144.39 0.46 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 123.778 0.674 . . . . 0.0 110.967 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.67 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 17.0 p -76.01 -77.16 0.14 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.45 -179.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.8 m 68.16 -61.09 0.4 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.107 0.563 . . . . 0.0 112.163 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.406 ' CG ' ' H ' ' A' ' 25' ' ' ASP . 9.5 t70 -132.04 -164.7 1.49 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -175.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.406 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 28.3 t70 -71.25 -20.05 62.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.458 0.647 . . . . 0.0 110.242 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -77.77 -5.66 51.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.505 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.67 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -71.28 -0.85 39.32 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.892 -0.595 . . . . 0.0 114.026 -174.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.41 -24.48 60.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.011 0.434 . . . . 0.0 111.658 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.401 ' HD2' HD23 ' A' ' 149' ' ' LEU . 69.8 m-85 -66.1 -13.3 59.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.431 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.2 t -86.56 131.78 34.08 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 174.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -75.5 8.7 2.64 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -176.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -98.52 4.2 48.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.366 0.603 . . . . 0.0 109.636 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.402 ' O ' HG22 ' A' ' 46' ' ' THR . . . -71.14 138.0 49.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.474 177.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.428 ' HA ' ' CG2' ' A' ' 46' ' ' THR . . . -86.35 60.65 6.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.18 0.514 . . . . 0.0 111.613 -173.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -101.95 113.05 65.97 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.12 175.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.84 132.83 44.41 Favored 'Trans proline' 0 C--O 1.239 0.531 0 C-N-CA 122.776 2.318 . . . . 0.0 112.35 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.511 HG13 ' HB2' ' A' ' 44' ' ' TRP . 12.4 pt -126.11 130.34 72.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.523 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -86.78 98.68 11.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.417 177.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.0 t -126.16 129.13 72.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.97 -174.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 59.68 20.63 9.31 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.812 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 108.46 -14.26 35.89 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.584 -0.817 . . . . 0.0 113.551 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.407 ' HD2' ' HA ' ' A' ' 42' ' ' LYS . 12.6 tptm -124.79 161.84 25.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 117.938 0.869 . . . . 0.0 110.922 -172.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.5 m -96.71 115.44 27.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.898 0.38 . . . . 0.0 110.604 -177.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.511 ' HB2' HG13 ' A' ' 37' ' ' ILE . 67.4 m95 -96.65 129.33 33.25 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.688 178.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 27.3 Cg_exo -64.43 -25.61 63.34 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 123.185 2.59 . . . . 0.0 113.082 -176.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.428 ' CG2' ' HA ' ' A' ' 34' ' ' ALA . 0.9 OUTLIER -155.38 162.05 40.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.092 -178.566 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.2 m -66.15 -36.93 84.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.591 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -23.1 62.62 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -175.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -62.94 -45.14 93.88 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.88 0.371 . . . . 0.0 110.461 175.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -70.1 -41.99 73.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.509 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -59.61 -44.31 93.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.662 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.647 ' HG3' ' HA3' ' A' ' 78' ' ' GLY . 0.0 OUTLIER -69.53 -36.16 76.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.691 0.282 . . . . 0.0 110.95 -179.857 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.424 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -70.17 -39.06 75.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.925 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -81.53 -18.93 43.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.871 0.367 . . . . 0.0 110.733 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -59.7 -31.63 69.77 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.027 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.448 ' CE1' ' HA2' ' A' ' 78' ' ' GLY . 88.8 m-85 -95.71 132.38 40.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.772 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 84' ' ' PRO . 0.5 OUTLIER -88.93 0.85 56.25 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.443 0.64 . . . . 0.0 109.681 170.639 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -84.96 111.04 19.33 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 170.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.575 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 40.5 mt-10 -77.31 -10.87 59.7 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.714 -172.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -73.57 -45.01 55.89 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -66.21 -38.26 87.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.58 172.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.424 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.2 ttp180 -61.03 -38.41 86.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.653 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.575 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 48.9 mm-40 -60.72 -48.15 83.08 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.386 174.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.18 -49.56 76.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.835 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 74.7 mt -64.15 -27.8 43.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.556 -176.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 66' ' ' ARG . 41.3 ttp-105 -77.11 -23.73 51.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.735 0.303 . . . . 0.0 111.259 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 23.8 mtm180 -93.71 -14.64 26.1 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -174.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.0 m -85.75 131.44 34.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.246 0.546 . . . . 0.0 111.069 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.1 t -87.97 -7.11 57.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.751 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.447 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.5 m -87.59 116.05 64.86 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.252 -177.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 16.9 Cg_exo -69.03 -51.41 0.45 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.037 2.492 . . . . 0.0 112.551 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 86.2 mtp -63.02 -38.62 91.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 111.044 -175.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 61.1 t -64.59 -39.07 84.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.486 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -51.05 55.17 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.643 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -57.91 -39.77 78.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.56 -178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -65.71 -53.72 37.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.68 0.276 . . . . 0.0 111.234 -177.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -76.14 -18.96 58.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.937 0.399 . . . . 0.0 110.699 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.647 ' HA3' ' HG3' ' A' ' 52' ' ' GLN . . . -83.22 -21.58 58.54 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.753 -0.737 . . . . 0.0 111.98 178.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.6 ttm105 -73.35 -9.22 58.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.149 0.5 . . . . 0.0 110.437 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.623 ' OD1' ' HG2' ' A' ' 83' ' ' LYS . 10.2 t70 -51.92 131.95 31.64 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.154 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.597 ' HD3' ' O ' ' A' ' 81' ' ' ARG . 4.5 tmt_? -112.46 -7.42 13.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.184 0.516 . . . . 0.0 110.073 -177.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.2 m -79.87 -19.02 49.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.189 0.518 . . . . 0.0 110.272 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.623 ' HG2' ' OD1' ' A' ' 80' ' ' ASP . 42.5 mmtm -75.1 161.94 75.26 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.375 176.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.537 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 32.0 Cg_endo -64.36 115.21 3.04 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.231 1.954 . . . . 0.0 111.991 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.426 HD11 ' HG2' ' A' ' 81' ' ' ARG . 96.0 mt -90.0 166.96 13.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.021 178.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -86.0 142.81 28.5 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -178.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -58.54 -48.5 80.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.397 . . . . 0.0 110.834 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -96.44 32.87 1.9 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.985 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.5 ' O ' ' HB2' ' A' ' 93' ' ' LYS . 19.2 t-105 -55.67 -44.08 76.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.028 -178.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.16 -18.94 64.0 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.007 0.432 . . . . 0.0 111.33 -177.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.0 m -90.14 -43.37 10.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.666 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.406 ' O ' HG23 ' A' ' 96' ' ' VAL . 33.2 m -79.16 -17.25 13.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.621 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.5 ' HB2' ' O ' ' A' ' 89' ' ' TRP . 21.4 tttp -50.49 -50.16 53.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.458 0.647 . . . . 0.0 110.279 176.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.464 ' H ' ' HG2' ' A' ' 94' ' ' GLU . 3.4 mm-40 -63.28 -38.23 90.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.676 -178.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -79.74 -42.2 25.08 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.515 -173.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 92' ' ' VAL . 94.7 t -61.62 -41.76 91.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.871 0.367 . . . . 0.0 110.115 177.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 49.0 tpp -62.44 -45.48 92.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.397 177.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 98' ' ' ARG . 17.2 ttm180 -63.85 -38.13 89.96 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.8 178.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -61.79 -44.99 95.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.76 0.314 . . . . 0.0 110.395 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.79 -44.98 79.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.723 177.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.403 HD13 HD12 ' A' ' 149' ' ' LEU . 75.7 mt -59.52 -49.54 77.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.194 178.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -59.77 -48.56 81.2 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.557 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.88 -39.07 73.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.958 0.409 . . . . 0.0 110.629 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.81 -46.4 58.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.253 -175.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -82.02 -38.53 24.89 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -76.97 -33.93 57.61 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 122.086 -0.384 . . . . 0.0 111.577 -173.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -83.83 -2.8 57.12 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.141 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.407 ' HB3' ' HG ' ' A' ' 111' ' ' LEU . 65.7 m-70 -126.4 100.25 6.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.463 177.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.4 -32.0 66.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.89 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.466 ' HB3' HG21 ' A' ' 3' ' ' VAL . 1.4 mp0 -56.64 -50.6 71.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.089 177.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.407 ' HG ' ' HB3' ' A' ' 108' ' ' HIS . 22.3 mt -76.73 -31.47 57.16 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.509 -173.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -59.15 -44.41 92.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.959 175.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.97 -46.85 89.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.655 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 56.5 tp -59.19 -47.81 83.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.848 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.433 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 48.9 tp -62.47 -50.58 70.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.479 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.539 HD11 ' HB2' ' A' ' 156' ' ' LEU . 10.6 mp -70.95 -13.33 61.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.918 -175.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.83 -22.78 60.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.762 -0.199 . . . . 0.0 111.241 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.615 ' HA ' HD12 ' A' ' 8' ' ' ILE . 47.5 p -78.72 -29.99 45.66 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.561 -177.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.497 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -51.29 136.57 30.46 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.801 ' HD2' HG21 ' A' ' 11' ' ' VAL . 85.4 Cg_endo -101.39 42.57 3.19 Favored 'Cis proline' 0 CA--C 1.537 0.642 0 C-N-CA 124.757 -0.934 . . . . 0.0 113.152 -3.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.98 159.11 34.37 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 122.167 -0.333 . . . . 0.0 110.973 178.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.556 ' HB3' HG12 ' A' ' 16' ' ' ILE . 35.5 ttmt -89.49 121.09 31.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.836 0.35 . . . . 0.0 110.487 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.404 HD12 ' HB3' ' A' ' 149' ' ' LEU . 70.1 mt -89.67 108.82 19.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.718 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.63 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 96.1 t -137.91 117.31 14.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.523 -179.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 19' ' ' PHE . 44.9 tt0 -89.4 110.62 21.41 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 173.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.484 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 86.1 t60 -82.44 77.33 9.23 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 98.8 m -92.05 99.14 12.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 174.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.457 ' HG3' ' HA3' ' A' ' 137' ' ' GLY . 19.7 tt0 -79.37 -15.94 57.07 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.139 -171.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.409 ' O ' ' HB2' ' A' ' 130' ' ' ASP . 12.9 m120 -101.68 112.27 24.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.329 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 129' ' ' ASN . 23.8 m-20 72.84 110.19 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.119 0.887 . . . . 0.0 111.392 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.448 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -86.42 94.15 9.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.83 -179.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -159.73 111.08 2.0 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 51.5 m95 70.08 8.13 6.53 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.392 0.677 . . . . 0.0 111.322 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -125.61 -160.48 10.68 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.484 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 0.8 OUTLIER -89.89 -14.08 35.01 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 118.257 1.028 . . . . 0.0 109.768 177.425 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 69.22 17.52 72.21 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.21 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.468 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 90.11 9.33 65.69 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 121.048 -0.596 . . . . 0.0 113.514 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -160.98 -37.75 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 117.593 0.696 . . . . 0.0 112.716 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 147.78 -48.54 0.63 Allowed Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.716 -179.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -76.11 58.68 1.24 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.58 0.705 . . . . 0.0 110.403 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.448 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -125.51 15.23 7.18 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 174.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.442 ' C ' ' H ' ' A' ' 144' ' ' ARG . 55.4 mttm 68.99 55.92 0.42 Allowed 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.732 -0.734 . . . . 0.0 111.411 -174.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -68.91 4.9 1.29 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.544 0.688 . . . . 0.0 109.747 173.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 0.0 OUTLIER -52.89 -17.3 1.33 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.174 176.156 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 55.7 tp -58.56 -58.34 8.97 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 169.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.622 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -59.77 -30.7 69.8 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.831 175.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -67.07 -40.8 87.09 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 177.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 89.0 mt -67.87 -33.92 75.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.901 0.381 . . . . 0.0 110.228 176.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.404 ' HB3' HD12 ' A' ' 123' ' ' LEU . 8.2 mp -59.62 -41.65 90.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.839 172.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.622 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 53.7 mtt -61.55 -52.0 66.27 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 175.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -47.69 -54.27 12.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.332 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 56.7 tp -68.93 -39.98 79.28 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.211 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.433 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 59.8 ttp180 -58.3 -50.31 74.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.814 -177.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.617 ' HG2' ' O ' ' A' ' 150' ' ' MET . 14.7 mm-40 -59.98 -46.41 89.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.132 0.491 . . . . 0.0 110.177 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -59.53 -41.33 89.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.705 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.539 ' HB2' HD11 ' A' ' 116' ' ' LEU . 87.3 mt -77.17 -31.54 55.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.788 0.328 . . . . 0.0 110.846 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -64.27 -44.71 90.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.138 -179.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 154' ' ' GLU . 83.9 mt -57.25 -40.46 73.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.282 -179.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -80.14 -7.94 59.17 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.424 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -82.82 -26.93 31.25 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.27 -16.65 63.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.881 172.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.414 ' C ' ' H ' ' A' ' 164' ' ' HIS . 8.9 mm-40 -83.42 11.28 7.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.572 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -76.36 22.29 0.17 Allowed 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.898 0.38 . . . . 0.0 111.294 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . 0.414 ' H ' ' C ' ' A' ' 162' ' ' GLU . 65.7 t60 -72.09 97.12 1.86 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.192 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -140.45 114.17 8.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.148 174.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 70.3 t60 -141.43 -3.22 1.19 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.033 0.444 . . . . 0.0 110.649 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -122.07 132.04 54.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.598 -0.274 . . . . 0.0 110.865 178.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 7.9 p80 . . . . . 0 C--O 1.243 0.747 0 CA-C-O 118.6 -0.714 . . . . 0.0 109.82 179.551 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.426 ' HA ' ' OD1' ' A' ' 25' ' ' ASP . 27.4 ttt . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.774 0.321 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.425 ' HD3' ' N ' ' A' ' 1' ' ' MET . 11.5 Cg_endo -89.75 107.02 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 123.005 2.47 . . . . 0.0 111.257 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.4 t -83.55 63.24 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-O 121.32 0.581 . . . . 0.0 110.544 -174.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.498 ' HD3' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -77.24 81.47 3.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.584 176.13 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.595 ' HA ' HD13 ' A' ' 114' ' ' LEU . . . -60.45 -56.1 25.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.56 -178.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -83.93 82.7 8.23 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.295 0.569 . . . . 0.0 110.943 -177.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.517 ' HG3' HG13 ' A' ' 8' ' ' ILE . 1.8 ptm180 -123.07 -27.02 4.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.712 178.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.517 HG13 ' HG3' ' A' ' 7' ' ' ARG . 60.5 mt -99.78 119.07 47.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 178.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.505 ' H ' ' NE2' ' A' ' 9' ' ' GLN . 0.7 OUTLIER -64.85 -59.37 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.174 0.512 . . . . 0.0 109.88 -177.741 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.412 ' C ' ' H ' ' A' ' 12' ' ' MET . 2.1 m80 -124.78 130.73 52.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.876 174.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.7 m -74.97 10.6 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.884 174.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.465 ' HB2' ' OG1' ' A' ' 15' ' ' THR . 57.3 mtm 69.09 -160.59 0.18 Allowed 'General case' 0 C--O 1.232 0.157 0 O-C-N 123.858 0.724 . . . . 0.0 109.9 -179.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -127.72 141.91 51.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -177.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 59.82 27.73 17.09 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.339 0.59 . . . . 0.0 110.713 -177.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.465 ' OG1' ' HB2' ' A' ' 12' ' ' MET . 96.8 m -92.7 124.09 36.46 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.168 -177.065 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mp -100.03 116.42 43.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.431 176.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 61.2 mt -89.86 96.73 6.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.416 0.627 . . . . 0.0 109.458 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -101.04 130.1 47.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.003 -177.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.0 p90 -132.1 177.33 7.65 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.091 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.51 103.99 5.02 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.419 177.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.1 m 63.02 -155.5 0.33 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.153 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.657 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 17.4 p -74.13 -16.0 61.02 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -177.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 m 47.67 -94.99 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 O-C-N 123.809 0.693 . . . . 0.0 111.34 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -162.46 115.27 1.69 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.581 174.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.426 ' OD1' ' HA ' ' A' ' 1' ' ' MET . 22.1 t70 68.48 -68.95 0.16 Allowed 'General case' 0 N--CA 1.47 0.565 0 O-C-N 124.069 0.855 . . . . 0.0 112.321 174.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -78.37 -1.43 33.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.528 0.68 . . . . 0.0 111.087 -175.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.657 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -74.36 -0.24 56.91 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.361 175.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -46.27 -28.45 1.29 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.05 0.94 . . . . 0.0 112.955 -176.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -53.58 -38.69 64.16 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.583 0.23 . . . . 0.0 111.584 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 10.9 t -61.82 143.89 55.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.197 0.522 . . . . 0.0 110.819 -176.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -65.26 -31.57 72.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.001 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -77.51 9.99 2.92 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.303 0.573 . . . . 0.0 110.924 -176.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.78 142.56 46.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.661 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.55 62.23 4.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.592 0.71 . . . . 0.0 111.103 -175.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.447 ' CZ2' HD21 ' A' ' 111' ' ' LEU . 86.3 m95 -105.75 102.49 38.82 Favored Pre-proline 0 C--N 1.315 -0.895 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.041 173.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -56.91 131.0 42.83 Favored 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 122.903 2.402 . . . . 0.0 112.117 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.518 HG13 ' HB2' ' A' ' 44' ' ' TRP . 18.3 pt -122.32 126.33 74.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.501 0.667 . . . . 0.0 111.248 -178.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -88.17 103.24 15.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 175.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.402 ' HB ' ' CD1' ' A' ' 44' ' ' TRP . 21.8 t -127.43 125.32 65.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.826 -174.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 62.42 23.72 14.08 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.787 0.679 . . . . 0.0 111.209 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.61 13.25 76.23 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.31 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.667 ' HD2' ' HD3' ' A' ' 66' ' ' ARG . 71.7 mmtt -117.46 154.62 31.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 m -105.19 106.28 16.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.828 0.347 . . . . 0.0 110.462 179.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.518 ' HB2' HG13 ' A' ' 37' ' ' ILE . 32.8 m95 -105.13 121.46 46.35 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -59.11 -34.5 98.73 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.735 2.29 . . . . 0.0 112.768 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.8 p -146.4 165.38 29.52 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -179.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.85 -28.99 69.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.793 0.33 . . . . 0.0 111.438 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 7.6 mp0 -64.78 -28.55 69.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.632 -178.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.403 ' HB3' ' HE3' ' A' ' 44' ' ' TRP . 36.3 m80 -64.7 -47.06 79.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.471 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -70.87 -35.72 72.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.388 0.613 . . . . 0.0 109.608 177.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -58.51 -41.77 86.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.834 177.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.662 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 68.3 mm-40 -74.37 -46.65 39.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.414 178.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.93 -38.63 76.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.986 -176.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -84.14 -24.5 30.21 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.542 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.661 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.1 ttmp? -60.01 -42.6 94.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.154 0.502 . . . . 0.0 110.242 172.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.433 ' HD1' ' O ' ' A' ' 52' ' ' GLN . 21.8 m-85 -77.37 135.07 38.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.327 178.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.753 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.4 pt? -97.63 12.79 32.39 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.339 0.59 . . . . 0.0 109.484 175.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -98.5 128.52 44.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.91 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -69.94 -35.35 74.46 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -175.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -67.76 -36.92 81.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.849 0.357 . . . . 0.0 110.33 -178.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.406 ' O ' HG13 ' A' ' 65' ' ' ILE . 6.9 m-85 -77.79 -28.18 50.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.944 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 54.6 ttp85 -59.06 -51.8 68.49 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.036 0.446 . . . . 0.0 110.208 175.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -75.57 -19.38 59.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -69.12 -46.31 67.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.211 0.529 . . . . 0.0 110.184 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.608 HG21 ' HB2' ' A' ' 52' ' ' GLN . 68.7 mt -72.95 -19.63 18.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.396 0.617 . . . . 0.0 110.12 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.667 ' HD3' ' HD2' ' A' ' 42' ' ' LYS . 12.6 ttp180 -72.72 -28.17 62.5 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.324 170.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -78.36 -41.97 31.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.253 -176.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.504 HG21 ' HB ' ' A' ' 73' ' ' VAL . 8.4 p -65.28 121.38 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.562 0.696 . . . . 0.0 111.672 -175.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.8 m -77.32 -42.28 37.36 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.422 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.401 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 47.4 t -70.59 127.42 91.98 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.239 -176.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 19.7 Cg_exo -66.61 -30.69 42.25 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.799 2.333 . . . . 0.0 111.924 176.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.2 mmt -70.19 -37.88 75.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.134 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.504 ' HB ' HG21 ' A' ' 68' ' ' VAL . 47.4 t -71.99 -32.22 43.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.091 0.472 . . . . 0.0 110.078 177.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.09 -39.84 93.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.22 173.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.88 -34.72 79.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.05 175.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -61.5 -33.15 73.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.122 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 25.6 mmt -61.77 -50.84 70.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.563 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.14 -26.05 62.74 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.833 -178.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 79' ' ' ARG . 2.6 tpt180 -84.47 -0.22 52.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.932 0.396 . . . . 0.0 110.326 -178.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.02 -31.45 71.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.022 -177.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 75.6 -46.24 0.56 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.95 175.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.5 m -82.59 40.17 0.65 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.306 0.574 . . . . 0.0 111.189 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.407 ' HB3' ' CE2' ' A' ' 56' ' ' PHE . 44.8 mmtm -123.24 151.67 62.65 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.139 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.35 105.17 1.68 Allowed 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.286 1.991 . . . . 0.0 112.909 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.42 HD22 ' HD3' ' A' ' 55' ' ' LYS . 54.2 mt -86.8 145.32 26.66 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 174.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.588 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . 8.0 ptp180 -74.17 164.53 26.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.245 0.545 . . . . 0.0 111.934 -175.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tptt -67.68 -40.75 84.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.708 -172.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.415 ' O ' HG22 ' A' ' 92' ' ' VAL . 10.3 m120 -101.34 23.48 10.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.429 -172.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.402 ' CZ2' ' HE3' ' A' ' 55' ' ' LYS . 38.7 t-105 -58.69 -47.1 85.68 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -175.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -59.35 -29.21 67.5 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -175.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.4 p -90.29 -22.6 21.5 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -176.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 88' ' ' ASN . 31.1 m -108.24 -5.92 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -176.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -49.11 -53.64 19.75 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.095 0.474 . . . . 0.0 111.614 -178.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -71.02 -29.98 66.05 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.52 -178.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -71.35 -42.39 68.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.934 -178.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 79.6 t -60.41 -46.62 94.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.104 0.478 . . . . 0.0 110.218 176.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.439 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 52.6 ttm -64.85 -42.21 95.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.756 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -65.8 -33.5 76.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.731 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.42 -45.12 77.05 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.03 0.443 . . . . 0.0 110.154 175.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.45 98.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.607 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 97' ' ' MET . 95.0 mt -66.04 -32.59 74.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.85 177.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.569 ' HG2' HD11 ' A' ' 152' ' ' LEU . 1.9 tmm_? -64.88 -44.26 90.22 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -69.06 -32.66 72.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.031 0.443 . . . . 0.0 110.669 176.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -63.71 -47.98 78.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.106 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.426 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 56.8 m-85 -85.6 -43.3 13.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -69.36 -43.71 73.02 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.538 -174.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 27.6 mt-30 -80.1 -1.36 39.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.899 0.38 . . . . 0.0 111.44 -175.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -122.95 96.42 5.01 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 170.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -53.74 -38.19 64.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.945 -171.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -57.74 -45.8 85.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 178.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.447 HD21 ' CZ2' ' A' ' 35' ' ' TRP . 34.6 mt -68.72 -42.45 77.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.249 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.604 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 49.4 ttp85 -59.53 -45.21 92.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.551 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.57 -42.49 98.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.709 178.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.595 HD13 ' HA ' ' A' ' 5' ' ' ALA . 50.3 tp -61.71 -48.87 78.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.619 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 153' ' ' ARG . 47.8 tp -56.93 -43.56 81.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.906 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.855 HD23 ' HG2' ' A' ' 153' ' ' ARG . 47.9 mt -68.7 -35.04 76.67 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.168 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -76.15 -15.1 60.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -176.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 33.7 p -82.06 -21.42 36.88 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 120.199 -0.601 . . . . 0.0 111.913 -176.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.52 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -64.01 148.18 95.5 Favored Pre-proline 0 C--O 1.234 0.247 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.492 174.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -94.5 32.67 10.68 Favored 'Cis proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.906 -1.289 . . . . 0.0 113.544 1.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.31 140.91 48.81 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 176.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -85.79 119.93 26.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.539 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 40.6 mt -80.15 122.78 27.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.499 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 80.4 t -132.48 114.67 23.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.189 0.519 . . . . 0.0 112.123 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -77.99 115.77 17.98 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 167.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.566 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 59.9 t60 -87.8 77.23 8.62 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.739 -173.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.606 ' OG1' ' HA3' ' A' ' 134' ' ' GLY . 1.0 OUTLIER -77.33 96.75 4.69 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.779 -179.588 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -93.86 -16.03 24.47 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.796 -175.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -66.97 -43.92 81.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.493 176.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -163.25 152.96 15.32 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -178.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.19 85.64 5.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.405 0.621 . . . . 0.0 110.044 178.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.508 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 37.5 t80 -149.32 106.21 3.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.566 -176.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.612 ' H ' ' HB3' ' A' ' 142' ' ' LYS . 66.9 m95 65.74 10.06 6.49 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.652 -176.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.606 ' HA3' ' OG1' ' A' ' 127' ' ' THR . . . -131.26 -161.12 10.12 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.57 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.566 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 4.0 p-10 -91.42 -6.58 52.57 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.754 0.311 . . . . 0.0 111.301 -176.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 76.35 7.11 84.83 Favored Glycine 0 N--CA 1.454 -0.155 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.037 177.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.447 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 82.04 40.05 10.87 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.938 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -179.35 -25.91 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.343 0.257 . . . . 0.0 111.6 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . 0.438 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 132.37 -16.31 4.9 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 119.881 -1.152 . . . . 0.0 113.776 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -133.39 82.11 1.97 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 117.315 0.558 . . . . 0.0 110.459 -177.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.39 -60.91 0.19 Allowed Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.246 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.612 ' HB3' ' H ' ' A' ' 133' ' ' TRP . 1.7 ttmp? -175.48 48.87 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -65.76 5.11 0.5 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.003 -0.998 . . . . 0.0 112.735 -171.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.544 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 30.8 ttm180 -54.84 -22.45 14.58 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.405 ' HB2' ' HB3' ' A' ' 133' ' ' TRP . 66.5 tp -61.48 -59.03 5.87 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.715 0.293 . . . . 0.0 110.345 174.458 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.428 ' HA2' HD12 ' A' ' 149' ' ' LEU . . . -61.95 -31.58 79.02 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.567 176.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . 0.441 ' HB3' ' HA ' ' A' ' 144' ' ' ARG . 56.8 t80 -61.68 -43.91 97.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.529 -0.336 . . . . 0.0 110.137 176.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 94.0 mt -66.9 -36.37 82.14 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.76 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.428 HD12 ' HA2' ' A' ' 146' ' ' GLY . 97.5 mt -60.76 -44.65 96.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.554 177.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 73.2 mtm -74.26 -34.59 63.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.875 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.04 -49.63 77.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.486 0.66 . . . . 0.0 109.619 175.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.569 HD11 ' HG2' ' A' ' 102' ' ' ARG . 55.5 tp -65.5 -34.63 78.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.076 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.855 ' HG2' HD23 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -59.12 -40.09 84.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.449 -179.362 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.449 ' O ' HG13 ' A' ' 158' ' ' ILE . 13.7 mm-40 -64.71 -39.04 92.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.501 177.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -64.5 -43.67 93.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.088 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.531 ' HB2' HD21 ' A' ' 116' ' ' LEU . 89.1 mt -69.84 -31.13 68.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.888 0.375 . . . . 0.0 110.496 -177.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.88 -36.29 81.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.353 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 154' ' ' GLU . 97.4 mt -68.3 -42.72 84.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.62 178.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.71 -37.8 85.44 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.023 177.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -64.4 -35.54 81.25 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 7.2 tp -64.53 -29.52 70.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.379 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -78.92 11.15 2.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.78 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -60.7 108.04 0.78 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.511 0.672 . . . . 0.0 109.884 175.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -130.84 175.33 9.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.911 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -74.16 86.05 1.88 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.092 0.472 . . . . 0.0 110.588 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 7.4 t-80 -109.33 125.89 52.81 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -51.95 22.66 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.994 -173.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 20.9 m170 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.717 -0.659 . . . . 0.0 109.748 174.238 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.61 127.75 12.76 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.755 2.304 . . . . 0.0 112.635 -177.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 51.4 t -80.79 89.25 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -87.76 81.63 7.56 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.564 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.25 34.86 0.57 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.527 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -156.87 86.27 0.98 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.882 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 26' ' ' TYR . 16.0 mmt180 -114.93 -51.37 2.74 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 171.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.0 mt -106.9 104.41 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.422 177.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -99.51 -31.05 11.82 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.638 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -110.5 109.79 20.27 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.221 -178.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.1 m -85.98 159.01 3.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.979 0.419 . . . . 0.0 110.317 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.1 mtm -93.14 18.75 8.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.929 -176.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 65.78 115.8 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.311 -178.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.8 t70 52.48 66.54 1.19 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.608 0.718 . . . . 0.0 110.802 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -117.15 150.52 38.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.687 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.506 HG13 ' HD2' ' A' ' 122' ' ' LYS . 3.5 mp -98.73 107.58 20.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 120.973 0.416 . . . . 0.0 110.089 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.2 mt -90.78 111.05 23.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.946 0.403 . . . . 0.0 110.711 -178.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.463 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 0.9 OUTLIER -90.79 104.44 17.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.774 176.744 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -100.76 137.28 39.35 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.774 0.321 . . . . 0.0 110.458 -178.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.431 ' O ' ' HB3' ' A' ' 21' ' ' SER . 5.1 t80 -150.54 169.9 20.42 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.876 175.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.445 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 39.9 t 75.64 109.28 0.07 Allowed 'General case' 0 C--O 1.231 0.099 0 O-C-N 123.924 0.765 . . . . 0.0 111.721 175.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 p -81.17 2.54 27.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.388 176.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -91.57 -4.68 55.1 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.223 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -107.88 165.87 11.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.722 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -77.1 -15.11 59.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.923 -175.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.443 ' CZ ' ' HB2' ' A' ' 7' ' ' ARG . 1.4 m-85 -101.22 -1.55 33.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.916 0.389 . . . . 0.0 111.07 176.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' A' ' 21' ' ' SER . . . -75.74 0.16 62.22 Favored Glycine 0 C--O 1.229 -0.214 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.906 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -57.51 -32.95 67.54 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -63.14 -21.35 66.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.596 -177.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 75.7 m -68.05 144.26 55.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.254 0.549 . . . . 0.0 111.052 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -67.78 -20.2 65.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.86 -176.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -95.06 10.89 34.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.941 0.401 . . . . 0.0 110.9 -177.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.43 140.17 58.09 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.85 0.357 . . . . 0.0 111.286 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.531 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -86.08 59.43 5.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.94 -177.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 50.3 m95 -118.9 116.09 34.55 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.729 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' TRP . 28.4 Cg_exo -61.59 128.16 23.84 Favored 'Trans proline' 0 C--O 1.238 0.52 0 C-N-CA 123.098 2.532 . . . . 0.0 112.413 -178.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.528 HG22 ' HA ' ' A' ' 104' ' ' LYS . 16.4 pt -112.31 133.7 57.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.891 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -93.95 105.07 17.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.693 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.2 t -123.88 118.94 55.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.996 -175.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 58.62 27.86 16.34 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.631 0.582 . . . . 0.0 111.428 176.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 96.44 -7.96 66.38 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.131 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -114.67 135.68 53.89 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 122.209 -0.583 . . . . 0.0 110.802 -177.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.5 m -95.4 106.44 18.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.92 -175.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 65.6 m95 -91.38 128.83 45.41 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.795 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.44 -35.55 85.28 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.087 2.524 . . . . 0.0 113.412 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.531 HG22 ' HA ' ' A' ' 34' ' ' ALA . 65.4 p -148.84 165.25 32.06 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 9.3 m -56.83 -41.56 78.09 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.285 0.366 . . . . 0.0 110.703 177.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.787 ' O ' ' HB2' ' A' ' 52' ' ' GLN . 10.0 tp10 -73.65 -1.13 17.68 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.735 -177.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.428 ' NE2' HG13 ' A' ' 68' ' ' VAL . 18.1 m80 -85.03 -40.61 16.65 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 120.984 -1.073 . . . . 0.0 109.47 171.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -74.16 -35.97 64.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.274 0.559 . . . . 0.0 109.573 174.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.558 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 37.8 t80 -72.03 -31.29 66.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.495 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.787 ' HB2' ' O ' ' A' ' 48' ' ' GLU . 3.8 tp-100 -71.73 -45.74 60.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.297 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.92 -37.31 84.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.146 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -88.42 -8.23 55.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.348 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.618 ' HG3' ' CZ2' ' A' ' 89' ' ' TRP . 4.9 ttmp? -69.46 -30.48 68.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.329 0.585 . . . . 0.0 109.936 175.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.49 ' CE2' ' HA2' ' A' ' 78' ' ' GLY . 91.3 m-85 -116.4 175.88 5.36 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.291 -178.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.28 7.23 9.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.792 178.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.781 ' HB2' ' HB2' ' A' ' 61' ' ' TYR . 27.9 m-20 -76.0 126.45 31.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.823 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.452 ' HG3' ' H ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -64.02 -36.52 84.26 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.49 175.942 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 64' ' ' GLU . 35.9 mmtm -65.18 -48.29 73.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.567 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.781 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -63.02 -45.75 90.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.154 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -54.74 -42.79 72.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.66 178.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.546 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 27.5 mt-10 -69.48 -40.64 76.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.355 178.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 6.0 mm-40 -63.77 -44.44 93.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.832 0.348 . . . . 0.0 111.319 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.664 HG21 ' HB3' ' A' ' 52' ' ' GLN . 74.7 mt -67.27 -26.13 35.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.358 0.599 . . . . 0.0 110.675 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 66' ' ' ARG . 0.0 OUTLIER -77.15 -14.99 59.7 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.92 174.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 84.8 mtp180 -96.15 -4.64 42.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.378 -178.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.428 HG13 ' NE2' ' A' ' 49' ' ' HIS . 10.0 p -110.35 132.54 58.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.047 0.451 . . . . 0.0 111.651 -174.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -93.66 -36.83 12.15 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.438 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 2.5 m -63.13 117.17 30.63 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.993 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 21.8 Cg_exo -65.36 -42.06 14.13 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.854 2.369 . . . . 0.0 112.79 -176.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.4 tpt -65.0 -36.15 83.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.098 -175.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 98.4 t -63.97 -44.01 97.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-O 120.928 0.394 . . . . 0.0 110.357 178.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.84 98.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.484 178.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.411 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -61.53 -41.64 97.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.05 178.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.64 -48.3 82.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.282 -179.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.6 ptp -71.61 -22.77 61.67 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.821 -178.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.49 ' HA2' ' CE2' ' A' ' 56' ' ' PHE . . . -77.88 -20.19 73.91 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.634 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.3 mtp85 -86.47 38.73 0.8 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.034 0.445 . . . . 0.0 111.396 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -111.05 109.6 19.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.5 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 81' ' ' ARG . 7.2 tpt180 -90.92 0.79 57.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.499 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.9 m -66.74 -37.84 85.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.035 -176.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.448 ' HD2' ' CE1' ' A' ' 56' ' ' PHE . 9.3 ptpp? -85.26 155.04 60.36 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.796 -178.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.63 117.74 5.26 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.329 2.019 . . . . 0.0 112.123 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.12 174.88 7.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.062 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.66 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 63.1 mtp180 -71.09 143.03 50.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.611 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -47.71 -44.6 27.79 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.174 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -118.01 27.03 9.25 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.474 -175.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.66 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 29.5 t-105 -58.69 -43.4 89.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.97 -15.86 60.22 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.11 -178.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 8.0 m -98.73 -48.89 4.78 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.903 0.382 . . . . 0.0 111.191 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.448 ' O ' HG23 ' A' ' 96' ' ' VAL . 33.4 m -76.69 -8.69 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.478 -176.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.462 ' HG2' ' HZ2' ' A' ' 133' ' ' TRP . 35.9 ttmt -48.63 -53.98 16.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.743 -179.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -69.88 -23.42 63.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.224 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -76.27 -42.92 43.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.962 0.411 . . . . 0.0 110.24 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 92' ' ' VAL . 87.7 t -60.56 -49.84 82.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.029 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 48.6 ttm -69.4 -33.19 72.64 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.991 -178.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 98' ' ' ARG . 14.2 ttm-85 -62.39 -41.65 98.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.769 0.319 . . . . 0.0 110.167 178.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -68.09 -39.31 82.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.617 178.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.64 -46.46 89.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.571 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 96.3 mt -63.9 -39.34 93.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.721 177.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 102' ' ' ARG . 21.5 ttt180 -58.62 -46.99 85.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.04 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.73 -33.16 73.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.884 178.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.528 ' HA ' HG22 ' A' ' 37' ' ' ILE . 61.2 tttp -56.28 -59.35 5.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.268 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.535 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 89.3 m-85 -82.49 -9.69 59.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.167 -176.356 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -87.95 -35.4 17.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.958 0.408 . . . . 0.0 110.721 177.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -77.17 -47.68 19.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.384 -177.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -92.88 108.44 20.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.705 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.16 -29.76 70.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.122 176.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.418 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.4 mp0 -55.94 -48.2 76.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.88 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 47.9 mt -74.51 -36.62 63.21 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.433 -176.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.535 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 25.5 ttm180 -59.53 -45.09 92.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.633 176.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.82 -39.41 94.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.587 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 tp -66.17 -44.36 84.27 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.551 177.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.417 ' HG ' ' HG3' ' A' ' 153' ' ' ARG . 53.6 tp -60.39 -51.94 67.35 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.302 179.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.456 HD21 ' HA ' ' A' ' 157' ' ' ALA . 11.0 mp -67.09 -23.09 65.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.595 -177.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -68.43 -22.6 64.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.596 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 44.9 p -71.08 -35.96 72.07 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 116.73 -0.213 . . . . 0.0 111.078 -178.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -49.31 135.86 16.44 Favored Pre-proline 0 N--CA 1.464 0.249 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.47 -179.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 89.5 Cg_endo -99.55 48.31 1.99 Allowed 'Cis proline' 0 CA--C 1.536 0.604 0 C-N-CA 124.184 -1.173 . . . . 0.0 113.495 0.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -88.5 160.32 17.55 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.811 0.338 . . . . 0.0 111.497 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.506 ' HD2' HG13 ' A' ' 16' ' ' ILE . 46.4 mttp -86.18 146.34 26.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.939 178.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.8 mt -108.53 112.71 25.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.144 177.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 98.6 t -128.97 124.5 61.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.875 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -86.84 117.34 25.51 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.415 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 7.1 t60 -98.24 80.1 2.63 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.427 -170.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.2 t -103.15 162.19 13.17 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 171.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -138.92 15.24 2.67 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.818 0.818 . . . . 0.0 109.81 177.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -81.77 -26.23 34.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.124 173.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -173.95 -174.15 0.9 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.607 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.46 ' HB1' ' HA3' ' A' ' 141' ' ' GLY . . . -135.32 85.6 2.18 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 175.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.497 ' C ' ' H ' ' A' ' 134' ' ' GLY . 13.1 t80 -149.13 116.45 6.11 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.462 ' HZ2' ' HG2' ' A' ' 93' ' ' LYS . 83.3 m95 74.04 -35.69 0.31 Allowed 'General case' 0 N--CA 1.477 0.919 0 O-C-N 123.908 0.755 . . . . 0.0 109.783 -169.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.497 ' H ' ' C ' ' A' ' 132' ' ' TYR . . . -117.63 -172.94 16.12 Favored Glycine 0 N--CA 1.43 -1.706 0 N-CA-C 108.184 -1.966 . . . . 0.0 108.184 177.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.62 ' HB2' ' HB2' ' A' ' 143' ' ' ASN . 0.8 OUTLIER -111.88 168.52 9.52 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 118.935 -1.106 . . . . 0.0 111.615 -175.863 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -79.18 36.24 1.96 Allowed Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.449 ' H ' ' C ' ' A' ' 135' ' ' ASP . . . 88.26 -14.75 58.5 Favored Glycine 0 CA--C 1.523 0.547 0 CA-C-N 114.935 -0.632 . . . . 0.0 114.329 177.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . 0.466 ' CE1' ' HB3' ' A' ' 140' ' ' LYS . 9.9 p80 -111.89 -53.66 2.69 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 118.202 1.001 . . . . 0.0 113.601 -171.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 130.54 53.24 0.1 OUTLIER Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.346 -0.931 . . . . 0.0 112.479 -175.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.466 ' HB3' ' CE1' ' A' ' 138' ' ' HIS . 60.8 tttp -172.92 37.43 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.208 0.528 . . . . 0.0 110.155 -178.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.46 ' HA3' ' HB1' ' A' ' 131' ' ' ALA . . . -123.42 -65.28 0.21 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 120.095 -1.05 . . . . 0.0 113.217 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.494 ' C ' ' H ' ' A' ' 144' ' ' ARG . 48.4 tttp -173.2 25.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 117.255 0.527 . . . . 0.0 112.211 175.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.62 ' HB2' ' HB2' ' A' ' 135' ' ' ASP . 9.9 t30 -51.54 5.65 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.19 1.396 . . . . 0.0 114.166 173.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.494 ' H ' ' C ' ' A' ' 142' ' ' LYS . 9.9 tpt180 -45.57 -21.02 0.08 Allowed 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 22.9 tp -57.58 -45.76 84.83 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.891 0.377 . . . . 0.0 110.496 174.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -62.64 -31.46 80.04 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.701 -0.559 . . . . 0.0 111.701 178.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -66.8 -39.76 87.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 175.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 70.1 mt -63.61 -42.56 98.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.953 176.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 98.8 mt -60.71 -45.52 93.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.831 178.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.553 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 71.5 mtm -67.25 -39.05 86.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.96 178.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -61.86 -45.38 94.01 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.126 0.489 . . . . 0.0 110.306 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 67.6 tp -64.58 -39.11 93.15 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.658 177.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.417 ' HG3' ' HG ' ' A' ' 115' ' ' LEU . 59.8 ttp180 -56.59 -49.8 73.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.314 177.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 150' ' ' MET . 14.1 mm-40 -62.13 -36.27 81.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.603 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -62.23 -56.13 21.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.313 176.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.491 HD22 ' NH2' ' A' ' 112' ' ' ARG . 37.3 mt -68.89 -25.14 64.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.098 -173.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' A' ' 161' ' ' LEU . . . -62.68 -52.39 63.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.107 173.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 73.0 mt -73.0 -38.26 55.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.794 -179.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -57.33 -47.39 81.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.477 177.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -79.61 -14.4 58.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.101 179.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 157' ' ' ALA . 18.5 tp -76.76 -20.52 56.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.169 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -67.06 -0.04 2.94 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.869 177.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -16.33 51.08 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-O 121.009 0.433 . . . . 0.0 110.2 171.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -88.32 75.46 8.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 175.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -71.81 126.08 28.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.322 -170.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 67.25 -87.52 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.801 175.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 173.44 -52.14 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -177.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 75.8 t60 . . . . . 0 C--O 1.248 1.0 0 CA-C-N 114.44 -1.254 . . . . 0.0 108.325 170.88 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.479 0.976 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.501 ' O ' ' HB ' ' A' ' 3' ' ' VAL . 26.6 Cg_exo -61.99 87.29 0.1 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.905 2.403 . . . . 0.0 112.03 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.501 ' HB ' ' O ' ' A' ' 2' ' ' PRO . 14.9 p 165.97 -30.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.364 -176.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.565 ' HB3' HE22 ' A' ' 6' ' ' GLN . 39.9 mtm105 62.41 83.53 0.15 Allowed 'General case' 0 C--N 1.342 0.254 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.141 -176.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.27 76.46 8.39 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.37 -176.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.565 HE22 ' HB3' ' A' ' 4' ' ' ARG . 2.3 mp0 -89.43 133.67 34.43 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.752 175.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.5 mtp85 -103.09 125.78 49.97 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.924 0.392 . . . . 0.0 111.983 -176.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 75.5 mt -74.38 122.37 27.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 166.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.4 ' OE1' ' HA ' ' A' ' 9' ' ' GLN . 6.7 tp60 -69.41 86.74 0.44 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.823 0.344 . . . . 0.0 110.781 -176.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 67.95 136.22 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.72 -178.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 m -84.75 16.18 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.991 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 43.3 mtm 66.77 -100.43 0.06 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.746 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 179.37 148.21 0.24 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 62.51 10.38 3.99 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 123.421 0.45 . . . . 0.0 111.603 177.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.1 m -83.35 114.36 21.37 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.302 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 51.6 mt -96.68 114.08 32.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.777 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.7 mt -93.21 109.97 22.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.433 -175.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.481 HD22 ' N ' ' A' ' 18' ' ' ASN . 0.9 OUTLIER -96.41 103.56 15.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.763 177.138 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -109.15 127.11 53.92 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.234 -176.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -150.55 100.59 2.87 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.66 170.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 m 161.89 101.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.209 1.404 . . . . 0.0 108.291 -177.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.53 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 10.2 p -79.46 -55.4 5.08 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.646 0.26 . . . . 0.0 111.376 -176.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m 56.65 -95.35 0.05 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.676 -176.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -178.2 21.03 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.094 0.473 . . . . 0.0 110.576 178.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.9 p30 -136.97 -90.95 0.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -86.41 -4.95 59.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.57 0.7 . . . . 0.0 110.182 -173.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.53 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -73.31 -0.02 50.65 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.223 -0.898 . . . . 0.0 112.945 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.464 ' HA ' ' CB ' ' A' ' 33' ' ' ALA . 34.5 t70 -54.54 -23.57 17.16 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -176.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -64.88 -29.11 70.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.599 178.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.1 t -77.6 143.47 38.26 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -62.04 -30.91 71.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.934 0.397 . . . . 0.0 110.824 -174.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.515 ' HB3' HG21 ' A' ' 22' ' ' THR . 16.7 t80 -75.47 11.53 1.24 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.416 -173.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.464 ' CB ' ' HA ' ' A' ' 28' ' ' ASP . . . -73.83 106.0 5.36 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 175.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.525 ' HA ' ' HB ' ' A' ' 46' ' ' THR . . . -74.32 59.93 0.81 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.624 0.726 . . . . 0.0 112.522 -171.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 62.0 m95 -93.67 125.54 53.17 Favored Pre-proline 0 C--N 1.312 -1.06 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.742 172.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.55 125.37 17.17 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 122.678 2.252 . . . . 0.0 112.042 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.666 HG22 ' HA ' ' A' ' 104' ' ' LYS . 15.3 pt -114.99 141.87 30.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.872 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -100.05 100.1 10.93 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.426 HG12 ' OD2' ' A' ' 40' ' ' ASP . 4.5 t -124.04 127.08 73.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.11 -174.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD2' HG12 ' A' ' 39' ' ' VAL . 24.6 m-20 63.5 6.7 2.64 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.965 0.791 . . . . 0.0 111.913 176.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 114.02 -3.13 24.14 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.556 -0.83 . . . . 0.0 113.088 177.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -123.15 155.28 37.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.247 0.523 . . . . 0.0 111.065 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.6 m -94.73 119.98 34.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.448 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.487 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 37.9 m95 -109.13 124.21 34.69 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.445 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.612 ' O ' ' HB ' ' A' ' 46' ' ' THR . 4.8 Cg_exo -76.05 48.05 2.16 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.32 2.68 . . . . 0.0 113.683 -175.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.612 ' HB ' ' O ' ' A' ' 45' ' ' PRO . 1.6 t 129.57 160.69 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.5 1.52 . . . . 0.0 109.701 172.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 m -58.77 -38.78 79.25 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 123.563 0.539 . . . . 0.0 111.294 -177.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.438 ' H ' HG23 ' A' ' 46' ' ' THR . 14.1 mp0 -53.11 -43.1 66.61 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.305 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 32.2 m80 -64.53 -39.52 93.92 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.328 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -76.1 -46.5 28.61 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.582 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -60.03 -50.03 75.34 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.578 -178.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.771 HE21 ' HA3' ' A' ' 78' ' ' GLY . 42.0 tp60 -64.63 -39.89 94.5 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.662 -177.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.918 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -68.71 -35.45 77.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.598 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -79.62 -16.84 55.1 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.909 0.385 . . . . 0.0 110.333 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.451 ' HE3' ' CD1' ' A' ' 89' ' ' TRP . 79.8 tttt -67.41 -21.8 65.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.793 -178.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.426 ' HZ ' ' CA ' ' A' ' 78' ' ' GLY . 82.2 m-85 -102.21 178.47 4.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.079 0.466 . . . . 0.0 111.901 -175.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.421 ' N ' HD12 ' A' ' 57' ' ' LEU . 5.6 mp -111.17 -37.01 5.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.642 -175.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.533 ' OD2' ' HB2' ' A' ' 61' ' ' TYR . 1.8 p-10 -75.5 111.65 11.02 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.602 0.715 . . . . 0.0 110.582 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -62.06 -32.85 73.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.658 -1.156 . . . . 0.0 111.791 -174.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.42 -37.9 76.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.105 0.479 . . . . 0.0 109.915 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.533 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . 2.0 t80 -77.06 -33.85 57.16 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.073 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.918 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 32.2 ttp85 -57.73 -44.84 86.3 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.372 0.606 . . . . 0.0 109.803 174.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -68.44 -31.57 70.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.233 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -70.14 -33.22 71.53 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.358 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 53' ' ' ALA . 75.2 mt -72.65 -23.19 20.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.005 0.431 . . . . 0.0 110.772 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.455 ' HB2' ' CZ3' ' A' ' 44' ' ' TRP . 55.3 ttp85 -84.33 -20.67 31.66 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.286 0.565 . . . . 0.0 109.637 171.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -75.99 -30.55 58.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.143 -177.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.9 p -78.47 129.31 37.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.92 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 43.9 t -77.19 -37.58 53.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.583 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.457 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 14.9 m -77.18 119.55 77.95 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 -177.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 22.1 Cg_exo -65.2 -37.59 31.24 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.844 2.363 . . . . 0.0 112.401 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.4 tpt -65.35 -41.15 94.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.819 -176.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 94.5 t -60.22 -38.05 75.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.129 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.437 ' HB1' HG23 ' A' ' 65' ' ' ILE . . . -60.81 -58.51 8.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.015 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 79' ' ' ARG . . . -60.98 -37.84 83.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.937 178.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.84 -49.92 73.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.73 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -78.42 -19.28 53.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.867 0.365 . . . . 0.0 110.967 -176.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.771 ' HA3' HE21 ' A' ' 52' ' ' GLN . . . -93.85 0.03 66.82 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.41 176.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.459 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 33.1 ttt180 -89.95 -9.93 46.98 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -79.03 164.38 24.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.573 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.451 HH11 ' HD3' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -94.21 -5.99 45.71 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.275 -174.104 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.7 m -72.33 -8.04 52.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.171 0.51 . . . . 0.0 111.299 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -111.71 123.44 34.74 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.033 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.8 119.9 6.86 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.422 2.081 . . . . 0.0 111.185 173.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 59.2 mt -88.87 156.5 18.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.05 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.651 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 67.1 mtt180 -61.85 125.96 25.68 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 176.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -54.11 -44.13 71.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.933 -174.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -102.07 27.29 6.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.378 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.651 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 73.7 t-105 -58.15 -44.12 87.7 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.235 179.037 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -61.36 -21.95 64.5 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.591 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.9 m -80.55 -38.05 30.31 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.783 0.325 . . . . 0.0 110.874 177.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.4 m -97.32 1.91 10.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.087 0.47 . . . . 0.0 111.228 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -55.64 29.49 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.964 -178.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.82 -28.9 70.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.362 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -70.01 -51.35 32.99 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.795 0.331 . . . . 0.0 110.522 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 87.3 t -62.72 -39.3 84.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.4 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.463 ' HA ' ' CE ' ' A' ' 97' ' ' MET . 3.3 tpt -63.4 -43.21 98.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.203 178.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.629 ' HA ' HD11 ' A' ' 148' ' ' LEU . 56.7 ttp180 -61.8 -40.48 95.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.772 179.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -65.33 -50.53 65.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.765 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.82 -45.87 87.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.406 -177.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.488 HD12 HD12 ' A' ' 148' ' ' LEU . 35.0 mt -65.17 -37.66 88.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.994 -176.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.649 ' HG3' HD21 ' A' ' 156' ' ' LEU . 31.2 ttp85 -67.67 -36.58 80.98 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.365 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.582 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -66.2 -31.77 72.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.117 0.484 . . . . 0.0 109.989 177.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.666 ' HA ' HG22 ' A' ' 37' ' ' ILE . 59.7 tttm -62.77 -49.35 75.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.886 179.115 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 81.8 m-85 -82.32 -33.32 29.0 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -176.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -75.26 -19.25 59.82 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 121.944 -0.472 . . . . 0.0 111.567 -179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.582 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.0 OUTLIER -86.38 -46.39 10.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.77 0.319 . . . . 0.0 110.242 177.329 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -99.39 100.22 11.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.423 ' HB1' HH21 ' A' ' 112' ' ' ARG . . . -62.29 -31.83 72.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.399 -173.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.489 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.6 pm0 -68.87 -33.87 74.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.666 0.27 . . . . 0.0 110.661 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 57.9 mt -73.19 -35.99 66.48 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 176.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.487 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 28.0 ttp85 -58.17 -48.67 79.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.478 175.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.58 -40.03 93.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.593 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.6 tp -61.5 -43.45 98.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.633 178.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 39.5 tp -62.04 -56.42 19.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.629 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.3 mp -66.88 -16.55 64.38 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.991 -0.284 . . . . 0.0 111.5 -176.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -75.96 -13.2 60.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 60.7 p -89.23 -16.44 31.24 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 120.39 -0.524 . . . . 0.0 111.441 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.507 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -55.7 139.41 68.92 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.722 176.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -101.26 39.14 4.8 Favored 'Cis proline' 0 CA--C 1.535 0.548 0 C-N-CA 124.295 -1.127 . . . . 0.0 113.492 -1.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.04 153.56 42.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 0.0 111.151 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.525 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 56.3 tttp -86.98 122.98 31.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.035 -178.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 42.9 mt -91.2 125.13 35.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.527 -177.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 87.9 t -138.54 138.09 42.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.241 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -107.26 141.98 37.74 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -105.25 77.58 1.31 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.52 0.676 . . . . 0.0 109.612 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.69 86.36 5.3 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.731 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -78.02 -23.72 48.12 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.001 -174.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -83.69 -22.36 32.08 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -175.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -154.69 148.34 25.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.866 0.365 . . . . 0.0 110.824 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.581 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -106.56 87.43 2.53 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.621 -177.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.524 ' HA ' ' HD2' ' A' ' 142' ' ' LYS . 3.7 t80 -147.55 -37.75 0.2 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.852 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.571 ' HB3' HD22 ' A' ' 145' ' ' LEU . 7.1 m95 -134.45 32.55 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -176.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -162.21 -128.35 0.94 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 119.66 -1.257 . . . . 0.0 112.374 -177.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.31 -7.98 16.52 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.335 0.588 . . . . 0.0 109.688 174.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 70.69 6.06 58.16 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.539 178.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 83.58 11.4 80.0 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.303 -0.475 . . . . 0.0 112.467 -176.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -164.06 28.22 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.689 0.244 . . . . 0.0 111.14 -177.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 81.18 -51.31 4.34 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.558 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -80.7 58.32 3.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.174 0.511 . . . . 0.0 110.823 -175.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.581 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -123.3 15.26 8.18 Favored Glycine 0 C--N 1.318 -0.461 0 CA-C-N 115.754 -0.657 . . . . 0.0 113.85 -178.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.524 ' HD2' ' HA ' ' A' ' 132' ' ' TYR . 50.3 mttm 69.12 78.47 0.21 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.253 0.549 . . . . 0.0 111.375 178.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -70.06 5.31 1.67 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.335 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -18.62 37.76 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -177.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.571 HD22 ' HB3' ' A' ' 133' ' ' TRP . 43.1 tp -65.79 -53.0 46.12 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 118.239 0.472 . . . . 0.0 109.993 175.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -58.92 -39.56 94.22 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 177.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -64.69 -44.87 88.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.714 -0.243 . . . . 0.0 110.659 177.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 98' ' ' ARG . 1.7 tm? -60.44 -45.94 91.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 90.5 mt -56.37 -43.46 79.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.157 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.525 ' SD ' ' HA ' ' A' ' 122' ' ' LYS . 73.8 mtm -72.46 -43.47 63.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.13 -179.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -66.73 -39.5 87.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.988 0.423 . . . . 0.0 110.457 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.502 HD11 ' HB2' ' A' ' 102' ' ' ARG . 55.0 tp -66.47 -37.65 85.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.849 176.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.641 ' HG2' HH11 ' A' ' 153' ' ' ARG . 23.3 ttp85 -61.23 -36.11 79.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.397 176.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 150' ' ' MET . 49.7 mm-40 -58.64 -49.18 78.45 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.035 0.445 . . . . 0.0 110.229 174.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -62.68 -46.01 90.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.831 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.649 HD21 ' HG3' ' A' ' 102' ' ' ARG . 97.8 mt -64.22 -32.96 74.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.752 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.35 -61.32 1.84 Allowed 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.09 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 69.6 mt -58.0 -38.47 67.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -170.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -64.23 -33.36 75.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.024 0.44 . . . . 0.0 111.228 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -94.03 -20.16 20.2 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.574 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 26.0 tp -72.63 -32.95 66.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.68 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.5 ' OE2' ' HB2' ' A' ' 164' ' ' HIS . 9.2 tm-20 -49.14 -52.68 24.75 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.554 173.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 70.7 -16.51 0.33 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.866 167.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . 0.5 ' HB2' ' OE2' ' A' ' 162' ' ' GLU . 86.9 m-70 -73.53 -21.22 60.45 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -57.6 103.51 0.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.107 173.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -117.2 121.14 40.4 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.942 -177.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -141.12 19.25 2.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.417 0.627 . . . . 0.0 109.625 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 . . . . . 0 C--O 1.244 0.811 0 CA-C-O 118.446 -0.788 . . . . 0.0 109.701 177.51 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 mmt . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 120.453 0.168 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -61.37 -38.64 62.98 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.542 2.161 . . . . 0.0 111.41 174.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.684 HG23 ' HB2' ' A' ' 25' ' ' ASP . 3.4 p -96.81 127.75 48.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 172.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 55.1 mtt85 -119.87 -36.85 3.2 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.114 -0.235 . . . . 0.0 111.235 -172.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.507 ' HB1' HD13 ' A' ' 114' ' ' LEU . . . 65.63 14.49 9.54 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.811 0.694 . . . . 0.0 110.472 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -100.96 17.2 22.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.833 -175.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.665 ' HB3' ' CD2' ' A' ' 26' ' ' TYR . 79.2 ttt180 -66.11 -35.36 80.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.286 0.565 . . . . 0.0 109.556 175.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.439 ' HB ' ' CZ ' ' A' ' 26' ' ' TYR . 67.1 mt -133.56 -65.74 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.294 174.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 73.56 -63.11 0.44 Allowed 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.917 0.76 . . . . 0.0 110.84 176.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -102.34 116.7 33.18 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 176.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.4 m -87.52 -175.14 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.113 -177.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.427 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 10.1 mtt -97.7 -85.41 0.36 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.587 -174.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.427 ' H ' ' HB2' ' A' ' 12' ' ' MET . 3.2 pt20 -177.97 114.68 0.08 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.873 179.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.9 t70 57.9 31.53 20.7 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.812 0.815 . . . . 0.0 110.289 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.5 m -76.33 146.4 38.85 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.766 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.2 mt -109.01 108.69 25.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.222 0.534 . . . . 0.0 110.516 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.4 mt -89.91 101.81 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.158 -175.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -97.45 101.15 12.62 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.123 172.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -101.19 154.06 19.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.823 -176.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -150.17 164.32 35.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.1 p 54.09 100.61 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.632 0.773 . . . . 0.0 111.843 -177.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -69.02 2.99 2.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.62 -175.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.0 p -56.41 -36.72 69.25 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -176.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -92.69 165.52 12.92 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.287 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.684 ' HB2' HG23 ' A' ' 3' ' ' VAL . 6.0 p-10 -82.57 2.17 34.45 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -171.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.665 ' CD2' ' HB3' ' A' ' 7' ' ' ARG . 0.9 OUTLIER -101.16 -4.4 27.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.187 0.518 . . . . 0.0 109.851 174.941 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -93.34 -0.23 67.77 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.682 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.462 ' CG ' HD22 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -58.0 -21.67 45.97 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -173.044 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.467 ' CZ ' ' HG ' ' A' ' 114' ' ' LEU . 97.1 m-85 -55.33 -21.73 16.25 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -177.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.531 ' HA ' ' OE2' ' A' ' 125' ' ' GLU . 22.8 t -62.42 141.68 58.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.097 0.475 . . . . 0.0 110.477 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -73.34 -21.38 60.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.751 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -90.81 6.08 45.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.176 0.512 . . . . 0.0 110.29 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.474 ' HB1' ' HD1' ' A' ' 35' ' ' TRP . . . -64.15 137.22 57.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.02 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.459 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -84.7 59.69 5.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.294 0.568 . . . . 0.0 111.136 -176.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.564 ' HB2' ' HE2' ' A' ' 104' ' ' LYS . 81.4 m95 -112.18 113.36 51.75 Favored Pre-proline 0 C--N 1.318 -0.796 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.882 176.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.58 125.65 19.73 Favored 'Trans proline' 0 C--O 1.237 0.475 0 C-N-CA 123.289 2.659 . . . . 0.0 112.785 -176.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.669 HG22 ' HA ' ' A' ' 104' ' ' LYS . 26.9 pt -115.95 146.44 20.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.681 179.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -109.72 103.32 12.13 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.4 t -122.77 124.06 69.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.705 -175.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 59.62 24.93 13.77 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 123.805 0.691 . . . . 0.0 111.085 178.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.27 -4.02 82.46 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.881 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -104.44 138.56 40.65 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 122.363 -0.492 . . . . 0.0 110.805 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.9 m -90.74 114.31 26.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.454 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.45 ' HB2' HG13 ' A' ' 37' ' ' ILE . 51.3 m95 -108.58 130.62 22.53 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.82 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 21.0 Cg_exo -65.95 -28.83 49.82 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.614 2.209 . . . . 0.0 112.467 -178.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.459 HG22 ' HA ' ' A' ' 34' ' ' ALA . 19.6 p -147.7 162.71 38.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.983 -177.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.1 m -66.85 -30.25 70.37 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.037 0.446 . . . . 0.0 110.616 178.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.402 ' OE1' ' HB3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -64.11 -28.99 70.15 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.611 -177.048 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.599 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 28.2 m80 -66.87 -41.81 86.68 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.971 -0.292 . . . . 0.0 110.845 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -70.9 -37.97 73.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.394 0.616 . . . . 0.0 109.511 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.524 ' HA ' HG11 ' A' ' 96' ' ' VAL . 78.3 t80 -61.35 -40.14 93.17 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.489 176.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.531 ' NE2' ' HA ' ' A' ' 75' ' ' ALA . 4.3 tp60 -72.28 -45.32 60.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.652 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.947 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -65.69 -38.91 90.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.168 -177.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.37 -16.94 44.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.582 0.215 . . . . 0.0 111.582 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.863 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.8 ttmp? -57.2 -38.39 73.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.156 0.503 . . . . 0.0 110.526 173.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -98.93 149.08 23.32 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.337 -178.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.803 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.3 pt? -95.71 1.95 53.71 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.244 0.545 . . . . 0.0 110.065 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -87.79 111.08 20.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.137 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.43 ' OE2' ' HD2' ' A' ' 62' ' ' ARG . 6.9 tp10 -60.43 -33.47 72.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.958 -177.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -62.71 -51.83 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.879 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.45 ' O ' ' HB3' ' A' ' 64' ' ' GLU . 0.5 OUTLIER -66.93 -29.8 69.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.018 0.437 . . . . 0.0 110.418 179.724 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.947 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 40.4 ttm180 -65.28 -41.32 94.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.122 175.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -62.96 -35.89 81.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.717 175.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 61' ' ' TYR . 11.4 tp10 -60.9 -55.43 33.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.905 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.55 ' O ' HG12 ' A' ' 68' ' ' VAL . 1.8 mp -61.98 -25.95 38.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 120.901 0.382 . . . . 0.0 111.309 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -71.87 -35.78 69.89 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 121.784 -0.572 . . . . 0.0 111.353 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -86.37 -0.03 55.04 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.702 -173.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.55 HG12 ' O ' ' A' ' 65' ' ' ILE . 11.9 p -95.59 117.54 39.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.32 0.581 . . . . 0.0 110.02 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.8 m -81.95 -24.97 35.25 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.991 0.424 . . . . 0.0 110.455 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.4 m -77.22 116.45 57.63 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.307 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.599 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 31.5 Cg_exo -59.85 -55.02 1.88 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.192 2.595 . . . . 0.0 113.064 -175.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 18.2 ttt -65.58 -22.84 66.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.498 -172.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 95.7 t -72.59 -37.79 57.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.838 0.351 . . . . 0.0 110.259 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.68 -45.81 92.74 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.051 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.531 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -62.2 -42.58 99.42 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.532 176.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -60.06 -55.91 28.08 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.579 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -74.78 -19.29 60.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.836 0.351 . . . . 0.0 111.121 -177.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -93.82 0.18 67.04 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.81 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 46.5 ttt180 -79.47 -0.61 33.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.196 0.522 . . . . 0.0 109.831 175.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -75.96 127.79 33.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.912 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.7 ttt180 -98.29 7.8 45.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.693 -175.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.2 m -83.01 -15.45 51.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.23 0.538 . . . . 0.0 110.344 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -79.32 150.24 73.63 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.147 179.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.429 ' HB2' HD21 ' A' ' 57' ' ' LEU . 18.3 Cg_endo -58.23 110.41 0.64 Allowed 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.657 2.238 . . . . 0.0 112.333 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.2 mt -85.99 120.77 27.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.829 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -68.63 134.0 49.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.257 0.551 . . . . 0.0 110.292 -178.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.51 -28.46 64.97 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.447 -170.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -90.88 16.88 8.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.561 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.484 ' CZ3' ' HA ' ' A' ' 55' ' ' LYS . 53.7 t-105 -58.98 -33.37 70.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.301 0.572 . . . . 0.0 109.871 174.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -56.63 -42.13 78.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.255 175.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 m -81.01 -43.34 19.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.69 -175.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.438 HG22 ' HA ' ' A' ' 89' ' ' TRP . 29.6 m -87.45 -3.46 9.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -170.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.48 ' HG3' ' N ' ' A' ' 94' ' ' GLU . 6.3 ptpp? -57.36 -36.88 71.78 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.839 0.352 . . . . 0.0 110.764 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.48 ' N ' ' HG3' ' A' ' 93' ' ' LYS . 7.6 pt-20 -78.41 -33.53 48.65 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.135 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -63.1 -43.77 97.57 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 -178.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.524 HG11 ' HA ' ' A' ' 51' ' ' PHE . 54.4 t -64.16 -49.17 82.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.382 176.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 10.1 mmt -61.45 -54.13 47.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.865 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -64.34 -27.09 68.79 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.789 -0.187 . . . . 0.0 111.314 -175.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -77.41 -46.38 22.85 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 176.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.64 -42.06 98.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.738 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 91.5 mt -64.88 -37.42 87.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.705 178.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.503 ' HA ' HD21 ' A' ' 152' ' ' LEU . 21.5 ttm-85 -63.46 -45.03 92.7 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 177.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.527 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -63.49 -38.37 90.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.781 0.324 . . . . 0.0 110.311 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.669 ' HA ' HG22 ' A' ' 37' ' ' ILE . 15.0 tptp -54.11 -56.3 19.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.499 176.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -80.64 -46.48 15.56 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -175.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.508 ' OE2' HD22 ' A' ' 156' ' ' LEU . 18.2 mm-40 -65.61 -21.56 66.59 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -175.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.8 tp-100 -79.29 -44.48 21.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.096 0.474 . . . . 0.0 110.506 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 64.5 m-70 -99.54 112.23 24.47 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.924 -176.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -59.39 -32.16 69.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.844 0.354 . . . . 0.0 110.352 178.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.412 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.3 mp0 -58.01 -60.1 4.24 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.034 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.462 HD22 ' CG ' ' A' ' 28' ' ' ASP . 13.0 mt -69.44 -34.47 74.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.497 -175.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 108' ' ' HIS . 18.8 ttt180 -54.86 -54.67 39.41 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.137 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.13 -36.73 80.16 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.565 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.507 HD13 ' HB1' ' A' ' 5' ' ' ALA . 42.9 tp -58.09 -48.5 79.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.803 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.441 HD23 HD12 ' A' ' 156' ' ' LEU . 49.2 tp -58.61 -48.78 79.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.26 178.239 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.527 HD21 ' HB2' ' A' ' 156' ' ' LEU . 33.5 mt -70.16 -18.4 63.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.764 0.316 . . . . 0.0 111.339 -175.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -80.74 -14.82 57.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.682 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 72.9 p -73.74 -31.62 63.45 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.297 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.49 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -57.71 136.37 82.82 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.993 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.49 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 72.4 Cg_endo -100.44 72.13 0.16 OUTLIER 'Cis proline' 0 N--CA 1.455 -0.768 0 C-N-CA 124.267 -1.139 . . . . 0.0 113.529 -0.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -110.98 157.59 19.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.842 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.439 ' HA ' ' SD ' ' A' ' 150' ' ' MET . 0.3 OUTLIER -83.58 140.96 31.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.172 176.04 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.479 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 67.7 mt -109.02 114.83 28.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.304 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 42.3 t -129.09 115.9 38.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.153 -177.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.531 ' OE2' ' HA ' ' A' ' 30' ' ' SER . 40.2 tt0 -80.73 133.63 35.7 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 172.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 45.1 t60 -121.75 119.47 31.8 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.194 -175.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 13.0 t -121.9 166.45 14.39 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 170.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.49 ' HA ' ' HA3' ' A' ' 137' ' ' GLY . 3.9 mp0 -116.34 4.93 13.48 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.946 173.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -124.63 110.97 15.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.524 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 25.7 t70 74.47 112.75 0.07 Allowed 'General case' 0 N--CA 1.465 0.291 0 O-C-N 124.563 1.164 . . . . 0.0 111.867 176.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.664 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -86.39 112.79 21.79 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.964 178.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -155.21 -68.49 0.12 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.452 -176.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.568 ' HB3' HD22 ' A' ' 145' ' ' LEU . 92.1 m95 -110.34 58.18 0.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.414 0.626 . . . . 0.0 109.504 177.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 131.31 156.73 8.57 Favored Glycine 0 N--CA 1.442 -0.95 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 -171.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.987 ' HA ' ' HA3' ' A' ' 141' ' ' GLY . 14.2 t0 -54.75 137.34 44.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.769 0.284 . . . . 0.0 111.715 -174.032 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -88.01 31.18 4.79 Favored Glycine 0 C--N 1.333 0.367 0 O-C-N 123.58 0.55 . . . . 0.0 111.988 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.49 ' HA3' ' HA ' ' A' ' 128' ' ' GLU . . . 78.98 54.48 4.12 Favored Glycine 0 C--N 1.317 -0.486 0 CA-C-N 114.838 -0.681 . . . . 0.0 114.076 177.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . 0.495 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 4.7 p80 -174.79 -37.11 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 135.09 25.36 0.54 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 120.194 -1.003 . . . . 0.0 112.654 -175.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.495 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 96.9 mttt -156.68 91.01 1.19 Allowed 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.987 ' HA3' ' HA ' ' A' ' 135' ' ' ASP . . . -142.16 1.18 1.65 Allowed Glycine 0 C--N 1.312 -0.776 0 C-N-CA 119.614 -1.279 . . . . 0.0 114.604 -178.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.419 ' C ' ' H ' ' A' ' 144' ' ' ARG . 24.5 mtmm 65.29 88.96 0.1 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.634 0.73 . . . . 0.0 110.37 -176.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -67.56 5.21 0.84 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.378 178.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.604 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 5.9 mmt180 -54.09 -24.74 18.62 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.568 HD22 ' HB3' ' A' ' 133' ' ' TRP . 52.1 tp -65.89 -52.96 45.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.106 0.479 . . . . 0.0 109.893 175.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 123' ' ' LEU . . . -66.21 -28.3 73.59 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.658 176.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -64.71 -37.74 88.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 91.9 mt -69.8 -35.91 75.23 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.374 175.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.473 HD12 ' HA2' ' A' ' 146' ' ' GLY . 95.7 mt -61.59 -44.68 96.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.185 176.188 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.551 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 74.3 mtm -72.74 -30.95 64.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.782 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -62.32 -54.2 44.04 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.503 HD21 ' HA ' ' A' ' 102' ' ' ARG . 56.6 tp -61.25 -39.3 89.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.847 178.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -53.0 -55.32 24.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.045 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.551 ' HG2' ' O ' ' A' ' 150' ' ' MET . 11.4 mm-40 -62.36 -39.19 92.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.222 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.804 HE21 ' HA ' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -61.18 -45.66 93.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.507 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.684 ' O ' ' HG2' ' A' ' 160' ' ' LYS . 87.2 mt -64.55 -44.78 89.68 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.458 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.18 -51.47 68.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.165 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 154' ' ' GLU . 82.1 mt -55.78 -40.98 64.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 O-C-N 123.072 0.232 . . . . 0.0 110.632 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.2 -47.9 84.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.686 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.684 ' HG2' ' O ' ' A' ' 156' ' ' LEU . 46.6 mmtm -67.13 -35.23 79.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.739 -177.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.48 -23.23 65.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.513 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -81.61 4.85 20.05 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -175.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -72.47 87.8 1.2 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 122.232 1.015 . . . . 0.0 110.924 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -125.08 139.39 53.83 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.205 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -93.25 82.06 4.5 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.999 0.428 . . . . 0.0 110.664 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -119.85 26.28 9.42 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -78.2 73.2 4.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.589 0.709 . . . . 0.0 110.205 -178.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 78.6 t60 . . . . . 0 C--O 1.248 1.009 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.938 177.263 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.9 ttp . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.62 102.73 0.36 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.508 2.139 . . . . 0.0 111.866 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.54 125.4 28.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.085 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 72.9 mtm180 -115.66 11.36 15.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.556 -176.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.22 -25.29 65.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.45 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -81.61 35.52 0.41 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.582 -177.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -71.42 -45.53 62.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.815 0.341 . . . . 0.0 110.605 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.403 ' HB ' ' OH ' ' A' ' 26' ' ' TYR . 59.7 mt -89.12 89.15 3.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 175.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -82.49 3.11 29.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.873 -174.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 p-80 -166.2 140.99 4.5 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 31.7 m -104.36 176.66 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 120.661 0.267 . . . . 0.0 110.675 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.43 ' N ' ' SD ' ' A' ' 12' ' ' MET . 0.2 OUTLIER -99.93 -96.68 0.25 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.801 -174.164 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -146.65 116.27 7.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.286 -177.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 48.11 36.84 7.03 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 123.708 0.63 . . . . 0.0 111.917 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.2 m -76.32 125.08 28.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.805 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.689 HG13 ' HD3' ' A' ' 122' ' ' LYS . 2.2 mp -85.49 116.77 29.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 174.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.0 mt -96.71 98.43 7.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.956 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.515 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 45.4 m-80 -86.74 101.48 13.34 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 177.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.499 ' O ' ' HA ' ' A' ' 125' ' ' GLU . 49.7 p90 -103.8 146.48 28.56 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 177.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -150.34 141.58 23.2 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.503 -177.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 96.0 p 60.18 119.72 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.656 1.222 . . . . 0.0 112.358 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.777 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 0.6 OUTLIER -55.44 -64.66 0.77 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.931 178.61 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.3 m 45.87 -95.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.848 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -160.74 34.47 0.15 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 122.059 0.933 . . . . 0.0 108.556 -177.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -126.35 -145.29 0.32 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.167 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.403 ' OH ' ' HB ' ' A' ' 8' ' ' ILE . 0.2 OUTLIER -72.18 -1.42 15.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.424 178.613 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.777 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -60.64 -0.15 1.24 Allowed Glycine 0 CA--C 1.525 0.697 0 CA-C-N 115.787 -0.642 . . . . 0.0 114.524 -178.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -55.12 -25.48 31.98 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.011 0.905 . . . . 0.0 111.073 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -65.51 -36.95 85.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.763 174.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.0 m -57.32 145.69 31.38 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.511 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -81.22 10.85 4.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.868 -175.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -105.48 6.27 32.25 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.49 0.662 . . . . 0.0 109.481 175.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.519 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -71.43 141.92 50.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.635 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.62 52.53 1.91 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.101 0.477 . . . . 0.0 111.616 -176.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -108.26 106.65 59.04 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.957 177.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -56.48 139.57 87.54 Favored 'Trans proline' 0 C--O 1.238 0.522 0 C-N-CA 123.064 2.509 . . . . 0.0 112.547 -178.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.509 HG13 ' HB2' ' A' ' 44' ' ' TRP . 24.7 pt -119.98 131.66 71.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.746 -178.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -96.62 93.56 6.82 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 44.5 t -102.66 123.61 56.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.85 -176.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 58.99 24.29 12.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.329 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 97.09 3.88 58.82 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.711 176.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.465 ' HD3' ' HA ' ' A' ' 42' ' ' LYS . 25.0 mmtp -128.01 152.12 48.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.133 0.966 . . . . 0.0 111.822 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.0 m -91.63 113.83 26.2 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.557 -171.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.509 ' HB2' HG13 ' A' ' 37' ' ' ILE . 63.4 m95 -101.29 128.53 29.06 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 172.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.55 -39.02 90.25 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.933 2.422 . . . . 0.0 112.521 -176.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.82 171.28 17.97 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.066 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.8 m -69.86 -43.33 72.11 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -172.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.628 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -62.5 -31.7 72.5 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -175.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.489 ' HE2' HG13 ' A' ' 68' ' ' VAL . 19.7 m80 -55.06 -41.85 71.99 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.459 ' CE2' HG13 ' A' ' 96' ' ' VAL . 55.2 t80 -73.07 -40.63 64.89 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.276 178.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.481 ' HA ' HG11 ' A' ' 96' ' ' VAL . 54.2 t80 -61.92 -51.74 66.91 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.977 -179.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.628 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 11.3 mm100 -62.35 -40.09 95.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.946 -177.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.484 ' HB1' ' HB2' ' A' ' 62' ' ' ARG . . . -66.95 -27.6 67.6 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.155 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -84.38 -19.83 32.94 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.542 -177.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -64.28 -52.62 57.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.981 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.556 ' HE1' ' HG3' ' A' ' 83' ' ' LYS . 84.9 m-85 -69.85 153.1 43.76 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -169.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.447 ' N ' HD12 ' A' ' 57' ' ' LEU . 6.0 mp -97.94 -1.45 42.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.883 173.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.666 ' HB2' ' HB2' ' A' ' 61' ' ' TYR . 5.8 m-20 -86.8 110.78 20.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.524 176.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -60.56 -36.46 78.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.116 0.484 . . . . 0.0 109.882 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -62.36 -41.38 98.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.7 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.666 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 1.8 m-85 -64.81 -44.8 88.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.319 -0.4 . . . . 0.0 112.006 -175.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.484 ' HB2' ' HB1' ' A' ' 53' ' ' ALA . 5.1 ptp85 -66.75 -31.16 71.63 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.951 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -70.15 -35.88 74.36 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 174.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -64.7 -40.73 95.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.866 176.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.56 ' HA ' HG12 ' A' ' 68' ' ' VAL . 72.5 mt -71.88 -20.65 20.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.212 0.53 . . . . 0.0 110.525 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -77.7 -10.13 59.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.108 0.48 . . . . 0.0 110.44 173.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -110.75 -28.53 8.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.294 -178.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' A' ' 65' ' ' ILE . 13.5 p -62.64 121.38 11.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.53 0.681 . . . . 0.0 111.315 -176.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.1 m -85.09 -12.68 52.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.159 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.403 ' H ' HG22 ' A' ' 68' ' ' VAL . 26.1 t -102.23 124.04 41.12 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.056 -177.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.96 -34.45 59.41 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.897 2.398 . . . . 0.0 111.99 177.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 85.2 mmm -66.41 -37.47 85.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.179 -177.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 94.9 t -68.1 -41.23 84.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.539 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.26 91.63 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.37 177.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.466 ' HA ' ' NE2' ' A' ' 52' ' ' GLN . . . -59.61 -42.28 92.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.859 176.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -60.8 -45.11 95.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.021 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 66.8 mtt -57.47 -51.1 70.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.303 0.573 . . . . 0.0 110.728 178.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.492 ' HA3' ' NE2' ' A' ' 52' ' ' GLN . . . -73.23 -14.25 79.21 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.783 -177.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -73.32 -31.34 63.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.68 0.276 . . . . 0.0 110.534 -178.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -64.92 138.01 58.11 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.044 0.45 . . . . 0.0 111.384 -177.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.439 HH11 ' HD2' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.54 4.64 28.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.639 -177.04 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.1 m -83.44 -31.98 26.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 0.0 110.06 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.556 ' HG3' ' HE1' ' A' ' 56' ' ' PHE . 32.2 mmmt -65.14 146.88 98.86 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.862 177.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 32.4 Cg_exo -59.57 148.07 88.97 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.929 2.42 . . . . 0.0 112.598 178.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 98.2 mt -112.39 159.72 18.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.33 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.7 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 54.4 mtp180 -83.29 153.24 24.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.374 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.13 -34.06 75.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.883 0.373 . . . . 0.0 110.627 179.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.441 ' O ' HG22 ' A' ' 92' ' ' VAL . 10.5 p30 -100.87 12.95 36.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.31 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.7 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 55.0 t-105 -65.81 -17.56 64.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.145 0.498 . . . . 0.0 109.758 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -65.26 -39.48 92.68 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.341 176.673 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.0 p -99.17 -42.49 7.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.465 ' O ' HG23 ' A' ' 96' ' ' VAL . 32.6 m -67.96 -14.03 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -167.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.639 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 35.2 mtmm -51.87 -44.25 63.63 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.096 0.474 . . . . 0.0 111.131 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -80.46 -25.36 38.93 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.624 -175.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.445 ' OE1' ' HA ' ' A' ' 92' ' ' VAL . 1.7 mp0 -70.87 -40.68 72.14 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 174.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.481 HG11 ' HA ' ' A' ' 51' ' ' PHE . 84.3 t -63.96 -48.75 84.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.772 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.3 ttm -70.43 -30.67 67.59 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.303 -178.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.1 ttm-85 -63.9 -38.0 89.46 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -65.22 -42.82 93.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.627 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.91 -48.28 81.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.786 178.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.2 mt -62.46 -46.7 87.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.074 178.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.507 ' HA ' HD21 ' A' ' 152' ' ' LEU . 49.8 ttt85 -59.14 -51.98 67.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.555 -178.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -62.78 -29.85 71.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 0.0 111.151 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.509 ' HA ' HG22 ' A' ' 37' ' ' ILE . 88.3 tttt -64.2 -53.65 45.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.821 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 86.2 m-85 -77.69 -22.95 49.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.88 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.431 ' OE1' ' HG2' ' A' ' 102' ' ' ARG . 44.3 mt-10 -72.34 -49.88 30.96 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.128 -0.358 . . . . 0.0 110.917 175.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.2 OUTLIER -71.68 -26.03 62.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.893 -175.918 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -116.52 101.93 9.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.908 0.385 . . . . 0.0 110.111 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.13 75.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.816 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.4 pm0 -69.41 -30.52 68.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.805 0.336 . . . . 0.0 110.621 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 29.2 mt -74.59 -37.51 62.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.775 ' HG3' HD13 ' A' ' 156' ' ' LEU . 16.5 ttm180 -64.17 -44.29 92.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.924 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.93 -43.91 97.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.375 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.1 tp -57.68 -48.42 79.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.809 176.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.412 HD23 HD12 ' A' ' 156' ' ' LEU . 43.4 tp -57.65 -44.83 85.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.845 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.49 HD21 ' HB2' ' A' ' 156' ' ' LEU . 78.8 mt -69.5 -29.52 67.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.539 -178.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -70.31 -17.34 63.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.705 -178.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 47.5 p -72.61 -35.63 67.89 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.745 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -50.92 133.44 29.2 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.824 -179.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 48.4 Cg_endo -100.55 38.65 5.21 Favored 'Cis proline' 0 CA--C 1.535 0.574 0 C-N-CA 124.184 -1.173 . . . . 0.0 113.432 1.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -75.1 157.96 33.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.288 0.566 . . . . 0.0 111.099 178.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.689 ' HD3' HG13 ' A' ' 16' ' ' ILE . 86.7 tttt -95.39 122.8 38.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.264 -173.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.3 mt -90.27 119.27 30.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.787 0.327 . . . . 0.0 111.216 -175.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.515 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 60.5 t -136.75 119.36 20.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.731 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.499 ' HA ' ' O ' ' A' ' 19' ' ' PHE . 37.7 tt0 -97.38 116.94 30.54 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 171.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.556 ' HA ' ' OD1' ' A' ' 135' ' ' ASP . 1.4 t-80 -87.1 77.11 9.18 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.354 -170.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 17.1 m -86.37 107.7 18.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.105 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.9 -28.5 11.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.61 -178.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -55.89 -42.44 75.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.52 177.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -140.42 136.18 32.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.432 -177.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -100.41 87.51 3.42 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.925 0.393 . . . . 0.0 110.844 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -146.55 -45.29 0.19 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.592 ' HB3' HD22 ' A' ' 145' ' ' LEU . 85.9 m95 -131.2 107.27 8.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.434 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 129.15 -149.77 18.65 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.031 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.556 ' OD1' ' HA ' ' A' ' 126' ' ' HIS . 3.8 m-20 -73.03 -28.83 62.57 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.97 0.414 . . . . 0.0 111.646 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 70.16 10.17 65.06 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 110.209 -1.156 . . . . 0.0 110.209 -168.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 92.29 -12.51 69.48 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 114.826 -0.687 . . . . 0.0 113.537 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -144.45 0.75 1.03 Allowed 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -174.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 111.28 -50.49 0.77 Allowed Glycine 0 CA--C 1.517 0.196 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.619 178.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -81.45 61.31 4.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.706 0.765 . . . . 0.0 109.955 178.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -132.13 15.21 5.08 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.777 176.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt 70.44 79.61 0.18 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.326 0.584 . . . . 0.0 111.865 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -77.72 5.42 9.4 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.755 0.788 . . . . 0.0 110.12 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.637 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 46.1 mtm105 -62.98 -8.19 6.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.878 -177.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.592 HD22 ' HB3' ' A' ' 133' ' ' TRP . 66.5 tp -66.61 -49.09 67.44 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 168.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -59.09 -37.89 92.28 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 173.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . 0.41 ' HB3' ' HA ' ' A' ' 144' ' ' ARG . 88.2 t80 -63.75 -45.81 88.18 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.581 -0.31 . . . . 0.0 110.911 176.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 87.9 mt -56.77 -41.4 77.58 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.887 0.375 . . . . 0.0 110.399 178.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.96 -45.88 91.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.947 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.565 ' O ' ' HG2' ' A' ' 154' ' ' GLU . 75.3 mtm -71.64 -36.57 70.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.235 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -62.81 -49.17 75.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.531 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.507 HD21 ' HA ' ' A' ' 102' ' ' ARG . 48.9 tp -66.16 -34.16 77.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.259 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 150' ' ' MET . 62.1 ttp180 -54.4 -48.81 71.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.693 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 150' ' ' MET . 5.7 mm-40 -59.96 -39.71 86.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.504 -178.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -63.78 -39.87 95.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.537 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.775 HD13 ' HG3' ' A' ' 112' ' ' ARG . 87.8 mt -78.29 -15.09 59.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.958 -178.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.419 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -79.69 -45.57 18.74 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 174.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 154' ' ' GLU . 63.5 mt -60.66 -29.28 44.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.104 177.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . 0.455 ' HB3' ' O ' ' A' ' 156' ' ' LEU . 5.5 tt0 -47.9 -53.83 14.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.408 174.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -80.71 -10.83 59.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.621 -174.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . 0.419 HD13 ' O ' ' A' ' 157' ' ' ALA . 8.2 mp -74.66 -22.01 59.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.022 0.439 . . . . 0.0 110.254 175.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -82.17 5.05 20.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.732 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -63.09 -23.32 67.39 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.852 0.358 . . . . 0.0 110.881 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 51.3 t60 -118.88 26.05 9.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.438 0.637 . . . . 0.0 109.683 -178.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -124.06 -170.3 2.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.058 178.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 31.1 m170 75.58 -72.59 0.1 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.486 0.714 . . . . 0.0 110.359 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -154.65 165.7 35.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.793 0.33 . . . . 0.0 110.766 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.452 -0.785 . . . . 0.0 109.735 176.456 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.4 mtt . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.412 ' O ' ' HG3' ' A' ' 4' ' ' ARG . 3.0 Cg_exo -75.02 107.93 2.6 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.394 2.062 . . . . 0.0 110.873 174.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.3 t -56.5 117.54 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.476 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 2' ' ' PRO . 44.4 mtm180 -115.44 97.2 6.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.314 -176.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.84 94.83 1.08 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 172.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -60.12 124.59 20.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.215 -174.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -95.17 99.93 11.82 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.379 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.66 115.78 20.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.524 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -58.76 -56.56 20.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.973 -177.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -154.1 132.83 12.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.35 -178.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.8 m -77.98 165.18 3.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.379 0.609 . . . . 0.0 111.291 176.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.732 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 13.8 mtt -95.39 50.42 1.24 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.047 -174.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 61.31 -94.88 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.886 -174.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -115.4 74.79 0.9 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.679 0.752 . . . . 0.0 109.317 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.732 ' HB ' ' HB2' ' A' ' 12' ' ' MET . 7.0 t -94.35 154.73 17.34 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.6 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.562 HG12 ' HB2' ' A' ' 122' ' ' LYS . 58.3 mt -111.1 123.6 67.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.029 0.443 . . . . 0.0 110.328 179.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 62.3 mt -101.7 105.57 18.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.107 -179.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.649 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 20.4 m120 -96.57 123.87 40.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.836 177.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -104.76 147.54 27.59 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.848 0.356 . . . . 0.0 110.863 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.599 ' HE1' ' O ' ' A' ' 126' ' ' HIS . 78.3 m-85 -126.99 114.29 17.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.652 -177.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.8 t 56.46 -150.18 0.44 Allowed 'General case' 0 CA--C 1.534 0.358 0 O-C-N 123.585 0.553 . . . . 0.0 109.702 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.515 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 26.0 p -89.45 -55.91 3.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 173.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.4 m 67.22 -69.68 0.13 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 174.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -129.9 179.75 5.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.181 -168.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -71.99 -27.4 62.73 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -73.38 -6.38 45.86 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.144 172.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.515 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -79.82 0.06 83.46 Favored Glycine 0 C--O 1.23 -0.129 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.653 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -49.14 -21.11 0.68 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -59.29 -21.8 60.22 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.947 0.403 . . . . 0.0 111.07 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.2 t -82.11 129.53 34.84 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.407 ' HB3' ' HB2' ' A' ' 47' ' ' SER . 42.0 m-80 -78.41 5.16 11.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.865 0.364 . . . . 0.0 111.514 -178.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -92.88 -3.17 55.07 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 175.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.16 136.66 52.45 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.925 176.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.68 60.82 4.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.42 0.629 . . . . 0.0 111.067 -174.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -104.02 120.88 49.68 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.591 175.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.484 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 30.8 Cg_endo -64.34 124.24 13.06 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.89 2.393 . . . . 0.0 112.523 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.6 HG22 ' HA ' ' A' ' 104' ' ' LYS . 25.9 pt -113.27 156.34 14.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.516 177.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -111.1 97.11 6.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.99 0.424 . . . . 0.0 110.258 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.545 HG13 ' HD3' ' A' ' 99' ' ' LYS . 87.8 t -119.04 122.85 70.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.23 -174.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 58.71 30.23 19.68 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 123.844 0.715 . . . . 0.0 110.839 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.5 14.82 75.26 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.754 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -126.16 143.13 51.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.894 0.347 . . . . 0.0 110.454 -179.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.3 m -91.5 115.74 28.29 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.348 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.503 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 72.9 m95 -105.23 133.18 20.28 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.926 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 8.9 Cg_exo -71.67 -11.26 27.76 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 123.071 2.514 . . . . 0.0 113.012 -177.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -165.6 146.6 7.06 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.407 ' HB2' ' HB3' ' A' ' 31' ' ' ASN . 14.7 m -57.59 -39.12 76.08 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.319 0.387 . . . . 0.0 111.107 178.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.406 ' OE1' ' HB2' ' A' ' 75' ' ' ALA . 41.4 tt0 -61.19 -28.01 68.83 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.675 -178.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.512 ' CE1' ' HA ' ' A' ' 71' ' ' PRO . 14.8 m80 -64.37 -44.74 90.41 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.847 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -74.19 -36.76 64.03 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.176 0.512 . . . . 0.0 110.005 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -61.61 -46.76 88.44 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.567 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.547 ' HB3' HD13 ' A' ' 65' ' ' ILE . 0.6 OUTLIER -71.72 -31.17 66.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.482 -178.941 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.4 ' HB1' ' HG2' ' A' ' 62' ' ' ARG . . . -65.97 -45.98 79.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.791 0.329 . . . . 0.0 111.001 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -77.2 -15.15 59.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.881 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 52' ' ' GLN . 87.1 tttt -63.22 -34.36 77.49 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.506 177.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -108.24 155.84 20.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.298 -178.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.696 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.5 pt? -108.1 11.84 27.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.13 -177.12 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -95.91 120.38 36.09 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 177.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.443 ' CD ' ' H ' ' A' ' 59' ' ' GLU . 1.5 mp0 -57.72 -43.51 85.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.606 -173.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 64' ' ' GLU . 86.3 tttt -64.76 -56.88 10.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.728 -176.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.424 ' CZ ' ' HE2' ' A' ' 83' ' ' LYS . 7.1 t80 -60.61 -35.74 76.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.197 0.522 . . . . 0.0 110.14 -178.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.543 ' HE ' ' HG3' ' A' ' 63' ' ' GLU . 2.6 tmm_? -58.48 -46.25 87.04 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.493 176.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.546 ' HA ' ' HB3' ' A' ' 66' ' ' ARG . 35.4 mt-10 -83.51 -7.17 59.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.917 -177.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 19.0 mm-40 -74.67 -39.32 62.08 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 169.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.547 HD13 ' HB3' ' A' ' 52' ' ' GLN . 54.7 mt -70.6 -26.19 28.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.602 175.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.546 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . 25.7 tpt180 -72.53 -29.58 63.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.506 172.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 25.9 ttm-85 -80.65 -37.41 30.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.889 -175.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.515 HG21 ' HB ' ' A' ' 73' ' ' VAL . 11.1 p -71.41 120.39 19.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.443 0.64 . . . . 0.0 111.332 -176.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.0 t -80.42 -36.19 34.05 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.533 178.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.7 m -69.72 124.35 90.42 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.744 -178.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.512 ' HA ' ' CE1' ' A' ' 49' ' ' HIS . 35.4 Cg_endo -65.53 -45.45 6.89 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.866 2.377 . . . . 0.0 113.083 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 25.0 ttt -63.75 -26.05 68.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.586 -174.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.515 ' HB ' HG21 ' A' ' 68' ' ' VAL . 54.2 t -72.53 -36.67 54.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.96 0.41 . . . . 0.0 110.16 178.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.98 -44.35 89.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.88 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.588 ' O ' ' HG2' ' A' ' 79' ' ' ARG . . . -57.45 -48.92 77.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.679 173.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -51.89 -64.06 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.842 -178.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -80.75 -4.88 56.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.134 0.493 . . . . 0.0 111.001 -175.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.52 -25.29 39.65 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 121.033 -0.604 . . . . 0.0 111.923 175.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.588 ' HG2' ' O ' ' A' ' 75' ' ' ALA . 58.6 mmt-85 -89.72 3.84 51.48 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 177.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -59.47 -42.85 92.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.798 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 71.25 -15.92 0.39 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.534 0.734 . . . . 0.0 112.341 173.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.1 m -90.27 23.61 2.84 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.219 0.533 . . . . 0.0 110.563 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.424 ' HE2' ' CZ ' ' A' ' 61' ' ' TYR . 12.3 mmmt -109.44 162.47 20.07 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 177.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.42 114.47 2.14 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.173 1.915 . . . . 0.0 112.154 178.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 92.5 mt -84.89 154.26 22.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.045 -177.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -82.34 144.8 30.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.957 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -69.39 -51.97 31.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.118 0.485 . . . . 0.0 111.011 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -86.59 27.56 0.95 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.939 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.465 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 41.3 t-105 -62.15 -23.42 66.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.571 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.448 ' HA ' ' NZ ' ' A' ' 93' ' ' LYS . 40.5 mm-40 -76.18 -18.63 59.0 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.016 178.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.1 m -99.8 -19.13 16.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.858 -177.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.44 ' HB ' HG23 ' A' ' 96' ' ' VAL . 28.3 m -111.06 2.11 8.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -168.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 89' ' ' TRP . 59.4 mttp -60.05 -59.91 4.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.448 0.642 . . . . 0.0 110.424 -179.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.567 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 1.4 pm0 -78.87 -17.19 56.01 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.04 -177.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.435 ' HB3' ' HA ' ' A' ' 92' ' ' VAL . 10.2 tt0 -77.75 -48.28 17.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.484 179.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.44 HG23 ' HB ' ' A' ' 92' ' ' VAL . 68.3 t -64.77 -40.85 90.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 120.963 0.411 . . . . 0.0 109.909 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.8 tpp -60.16 -39.08 85.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.483 177.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -63.59 -40.94 98.23 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.439 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.545 ' HD3' HG13 ' A' ' 39' ' ' VAL . 39.0 ttmt -63.48 -46.51 85.83 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 177.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.61 -43.58 98.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.643 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.704 ' HB3' HD22 ' A' ' 152' ' ' LEU . 35.4 mt -60.13 -49.63 76.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.464 178.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.594 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 32.1 ttt180 -64.84 -45.78 84.68 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.533 -178.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.44 -28.7 68.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.191 0.519 . . . . 0.0 110.786 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.6 ' HA ' HG22 ' A' ' 37' ' ' ILE . 53.9 tttm -70.24 -53.7 15.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.791 179.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -86.82 -0.03 55.69 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -177.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.864 ' HA ' HH21 ' A' ' 112' ' ' ARG . 1.8 mm-40 -92.08 -40.64 10.94 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.628 0.251 . . . . 0.0 110.846 172.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -71.26 -38.89 71.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.947 0.403 . . . . 0.0 110.758 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -109.33 110.19 21.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.155 -175.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.5 -24.03 63.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.176 176.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.445 ' H ' ' CD ' ' A' ' 110' ' ' GLU . 1.4 mp0 -58.71 -54.17 50.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.718 176.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 27.9 mt -69.59 -35.53 75.42 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.478 -176.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.864 HH21 ' HA ' ' A' ' 106' ' ' GLU . 42.5 ttm180 -57.37 -47.47 81.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.876 178.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.74 95.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.643 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.0 tp -61.29 -47.53 85.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.507 178.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.27 -45.67 92.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.026 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.526 HD21 ' HB2' ' A' ' 156' ' ' LEU . 74.3 mt -68.43 -18.82 64.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.6 -177.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -77.9 -7.28 56.51 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 63.5 p -85.3 -32.73 22.36 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.514 -178.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.04 136.36 14.38 Favored Pre-proline 0 N--CA 1.467 0.42 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -100.4 35.54 7.16 Favored 'Cis proline' 0 C--N 1.349 0.567 0 C-N-CA 124.45 -1.063 . . . . 0.0 113.156 -1.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -66.26 149.5 50.26 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.652 0.263 . . . . 0.0 111.222 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.562 ' HB2' HG12 ' A' ' 16' ' ' ILE . 55.7 mttp -79.87 125.38 29.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.735 179.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 53.9 mt -90.62 100.97 13.72 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.649 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 98.8 t -133.45 126.86 52.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.962 -174.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.575 ' CD ' HG22 ' A' ' 127' ' ' THR . 0.0 OUTLIER -83.6 136.59 34.18 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 174.425 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.762 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 72.5 t60 -134.26 77.24 1.69 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.955 0.407 . . . . 0.0 110.051 172.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.575 HG22 ' CD ' ' A' ' 125' ' ' GLU . 8.9 t -112.97 130.46 56.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.292 0.568 . . . . 0.0 109.544 175.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.506 ' HG2' ' CA ' ' A' ' 137' ' ' GLY . 29.2 mt-10 -87.81 12.35 13.2 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.436 -175.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -91.24 -35.24 14.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.583 -178.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -152.44 135.6 15.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.78 0.324 . . . . 0.0 110.864 -177.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.563 ' HB2' ' HA3' ' A' ' 136' ' ' GLY . . . -110.58 91.72 3.77 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.298 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -153.75 -31.15 0.12 Allowed 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.115 -178.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.418 ' HB3' HD22 ' A' ' 145' ' ' LEU . 78.6 m95 -137.15 36.92 2.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.591 0.234 . . . . 0.0 111.54 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.502 ' HA3' ' CD ' ' A' ' 125' ' ' GLU . . . -174.08 -114.9 0.37 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.162 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.762 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 16.3 t70 -111.62 -33.73 6.27 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.895 0.379 . . . . 0.0 110.866 -176.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.563 ' HA3' ' HB2' ' A' ' 131' ' ' ALA . . . 74.2 6.5 74.85 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.031 177.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.506 ' CA ' ' HG2' ' A' ' 128' ' ' GLU . . . 78.7 40.69 17.26 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.917 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -178.02 -22.68 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . 0.422 ' HA2' ' OD2' ' A' ' 135' ' ' ASP . . . 127.28 -44.11 1.27 Allowed Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.222 -0.989 . . . . 0.0 113.043 174.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -91.37 68.39 5.83 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.778 0.799 . . . . 0.0 109.163 -177.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.456 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -123.1 14.89 8.31 Favored Glycine 0 C--N 1.311 -0.838 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.842 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 75.8 mttt 61.74 69.77 0.62 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.28 0.562 . . . . 0.0 111.732 173.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.464 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 7.6 t30 -72.92 5.54 3.21 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.337 -174.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.593 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 77.8 mtm-85 -48.07 -24.21 1.03 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.418 HD22 ' HB3' ' A' ' 133' ' ' TRP . 50.7 tp -57.25 -56.05 26.77 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.656 0.265 . . . . 0.0 110.764 174.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.55 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -64.49 -30.43 77.85 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 121.282 -0.485 . . . . 0.0 111.895 178.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -64.58 -42.3 95.69 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 95.3 mt -61.5 -41.24 96.98 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.095 175.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.87 -38.77 89.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.025 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 63.9 mtt -60.46 -51.25 70.26 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.162 0.506 . . . . 0.0 110.217 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -64.6 -41.02 96.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.849 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.704 HD22 ' HB3' ' A' ' 101' ' ' LEU . 54.7 tp -62.34 -42.04 99.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 178.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -59.48 -56.27 24.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.539 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.6 -32.99 70.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.049 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -64.25 -40.03 95.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.789 177.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.526 ' HB2' HD21 ' A' ' 116' ' ' LEU . 96.0 mt -77.69 -22.98 49.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.985 0.421 . . . . 0.0 110.613 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.41 -50.37 26.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.045 174.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 80.7 mt -65.05 -26.25 39.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.402 178.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -52.76 -40.72 63.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.602 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -74.58 -30.62 61.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.827 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.7 mp -70.75 -33.54 70.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.215 0.531 . . . . 0.0 110.361 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -79.4 -34.34 41.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.176 174.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 14.1 p80 40.86 49.84 2.96 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.806 0.842 . . . . 0.0 111.35 -178.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -149.96 85.43 1.41 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.704 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -81.24 169.01 17.87 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.577 -173.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -63.23 144.72 56.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.334 177.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 34.2 t-80 -64.45 -28.3 69.58 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.045 -177.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 19.2 m80 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 118.597 -0.715 . . . . 0.0 109.216 174.002 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -71.36 -28.37 18.25 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.346 2.031 . . . . 0.0 110.89 171.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 40.4 t -82.89 137.84 20.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.799 178.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.839 ' HB2' ' HB3' ' A' ' 25' ' ' ASP . 21.6 ttt180 -128.04 50.5 2.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.107 0.48 . . . . 0.0 110.249 177.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.474 ' HA ' HD13 ' A' ' 114' ' ' LEU . . . -74.84 58.63 0.84 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.562 0.696 . . . . 0.0 110.063 174.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -87.54 129.15 35.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.627 -177.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.484 ' O ' ' HG3' ' A' ' 7' ' ' ARG . 34.8 ptt180 -64.96 106.25 1.2 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.47 0.652 . . . . 0.0 111.324 -177.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.486 ' H ' ' HB1' ' A' ' 117' ' ' ALA . 57.1 mt -87.0 86.15 2.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 174.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.33 11.46 37.93 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.773 -179.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 35.7 t-80 -138.83 94.6 2.84 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.246 176.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.53 HG21 ' HD2' ' A' ' 120' ' ' PRO . 33.3 m -99.74 170.56 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.3 mtt -72.67 -74.53 0.16 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.618 0.723 . . . . 0.0 109.695 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -175.71 -56.45 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.955 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -125.59 72.59 1.28 Allowed 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.26 -1.337 . . . . 0.0 107.648 168.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.59 ' HB ' ' HB2' ' A' ' 121' ' ' ALA . 4.2 m -76.62 154.54 34.26 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.622 -170.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.9 mm -115.79 124.11 71.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.422 HG12 ' HB1' ' A' ' 121' ' ' ALA . 45.5 mm -106.9 101.72 12.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.029 178.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -100.48 104.43 15.82 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -118.01 137.98 52.51 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.45 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.579 ' CE1' ' HA ' ' A' ' 127' ' ' THR . 8.9 t80 -150.28 149.33 29.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.486 176.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.5 p 66.61 154.01 0.08 Allowed 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.669 1.188 . . . . 0.0 111.941 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.564 HG21 ' HA ' ' A' ' 33' ' ' ALA . 1.8 m -93.98 0.23 55.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.539 0.685 . . . . 0.0 109.841 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m -75.12 -32.15 61.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.397 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.83 161.03 24.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.468 177.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.839 ' HB3' ' HB2' ' A' ' 4' ' ' ARG . 2.8 m-20 -68.05 -24.68 65.1 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.637 -176.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -76.37 -1.36 26.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.788 175.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 30' ' ' SER . . . -65.98 -3.27 16.06 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.808 -0.633 . . . . 0.0 113.176 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -61.63 -30.29 70.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.122 0.461 . . . . 0.0 110.553 174.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -72.94 -23.82 60.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.852 177.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 27' ' ' GLY . 29.2 t -58.83 138.1 57.42 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.464 0.649 . . . . 0.0 111.48 -176.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -72.93 -17.09 61.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.705 177.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -90.51 -5.62 55.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.365 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.564 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -64.0 146.86 53.36 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.832 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.38 59.22 3.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.268 0.556 . . . . 0.0 111.719 -174.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -109.99 109.7 59.05 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.993 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.53 139.08 68.41 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.703 2.268 . . . . 0.0 112.178 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.497 HG22 ' HA ' ' A' ' 104' ' ' LYS . 27.2 pt -124.86 138.31 54.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.018 0.437 . . . . 0.0 111.275 -177.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.623 ' H ' ' HG3' ' A' ' 107' ' ' GLN . 50.0 tptt -97.66 106.59 18.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.406 HG11 ' CZ ' ' A' ' 50' ' ' TYR . 15.9 t -126.44 126.84 69.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.45 -174.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 54.71 23.74 5.03 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 124.043 0.84 . . . . 0.0 112.141 173.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.04 -14.67 31.26 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.667 -0.777 . . . . 0.0 113.416 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -121.52 153.73 37.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.913 0.857 . . . . 0.0 111.322 -175.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 12.1 m -99.41 108.66 21.2 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.214 -176.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.472 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 48.3 m95 -97.99 135.18 21.54 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.607 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.585 ' O ' HG22 ' A' ' 46' ' ' THR . 11.4 Cg_exo -71.78 57.46 2.51 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.788 2.326 . . . . 0.0 112.412 176.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 45' ' ' PRO . 0.7 OUTLIER 92.98 170.11 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.672 1.589 . . . . 0.0 112.708 172.436 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 m -49.33 -47.82 46.93 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 114.33 -1.304 . . . . 0.0 112.517 -172.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -54.38 -33.53 59.38 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.917 0.389 . . . . 0.0 111.604 -175.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.413 ' CE1' ' HB2' ' A' ' 45' ' ' PRO . 44.7 m80 -75.66 -43.57 46.91 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 122.057 -0.402 . . . . 0.0 110.822 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.452 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 42.9 t80 -70.29 -26.28 63.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.952 0.406 . . . . 0.0 110.396 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.489 ' HA ' HG11 ' A' ' 96' ' ' VAL . 27.3 t80 -62.81 -52.87 61.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.512 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.78 ' HB3' HD13 ' A' ' 65' ' ' ILE . 2.4 mp0 -62.97 -34.39 77.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.594 174.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.684 ' HA ' ' HG2' ' A' ' 62' ' ' ARG . . . -65.72 -29.02 69.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.707 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.461 HE21 ' HA ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -105.41 2.92 29.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.124 0.487 . . . . 0.0 110.06 178.602 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -83.71 -57.94 3.01 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.214 174.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.579 ' CE1' ' HB2' ' A' ' 83' ' ' LYS . 57.0 m-85 -88.02 143.24 27.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.505 -179.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.759 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.5 pt? -102.08 8.71 40.74 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.631 0.253 . . . . 0.0 111.657 -175.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -89.43 121.74 31.96 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.27 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -59.03 -44.86 91.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.443 -176.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -68.47 -52.73 29.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.508 -174.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -67.28 -30.74 70.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.857 0.36 . . . . 0.0 110.864 -178.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.684 ' HG2' ' HA ' ' A' ' 53' ' ' ALA . 5.3 tmm_? -68.67 -34.46 75.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.298 0.57 . . . . 0.0 109.5 177.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -67.18 -27.76 67.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.534 175.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.429 ' O ' ' HB3' ' A' ' 67' ' ' ARG . 1.3 tp10 -72.74 -28.61 62.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.231 176.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.78 HD13 ' HB3' ' A' ' 52' ' ' GLN . 37.9 mt -77.05 -22.24 14.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.276 0.56 . . . . 0.0 110.595 177.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -76.69 -19.74 57.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 170.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' A' ' 64' ' ' GLU . 7.3 tpp180 -75.78 -43.53 46.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.605 -179.291 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.7 p -63.86 120.34 10.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.334 0.588 . . . . 0.0 110.423 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.2 m -86.0 -31.72 21.89 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.289 -177.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.425 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 35.5 t -72.32 123.37 89.41 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.77 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 17.0 Cg_exo -67.8 -34.41 24.35 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.74 2.293 . . . . 0.0 111.652 177.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.473 ' HA ' ' CE ' ' A' ' 72' ' ' MET . 2.2 tpt -67.48 -47.25 70.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.521 -178.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.8 t -65.3 -37.48 80.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.46 -47.55 83.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.83 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.534 ' O ' ' HG3' ' A' ' 79' ' ' ARG . . . -66.7 -41.13 88.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.443 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.3 tpt180 -55.3 -53.73 52.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.032 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -80.2 -23.78 40.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.815 0.34 . . . . 0.0 110.775 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.56 -8.24 85.91 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.955 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 75' ' ' ALA . 89.7 mtt180 -89.34 -6.83 56.34 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 122.392 -0.475 . . . . 0.0 110.921 175.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -71.87 125.26 26.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.011 0.434 . . . . 0.0 109.955 176.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.659 ' HG3' HD11 ' A' ' 85' ' ' LEU . 14.5 ttm180 -96.9 15.58 21.82 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.554 -174.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.1 m -91.74 -8.04 48.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.931 178.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.579 ' HB2' ' CE1' ' A' ' 56' ' ' PHE . 45.2 mmtm -88.77 162.32 38.99 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.422 176.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 51.5 Cg_endo -68.7 100.92 0.72 Allowed 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 121.883 1.722 . . . . 0.0 112.532 -178.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.659 HD11 ' HG3' ' A' ' 81' ' ' ARG . 97.1 mt -84.35 150.13 25.58 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.686 174.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -82.28 143.35 31.38 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 174.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -57.99 -31.43 66.92 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -169.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -104.6 21.99 15.81 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 121.031 -0.268 . . . . 0.0 111.296 -176.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.451 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 43.3 t-105 -58.43 -48.53 80.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.451 -177.117 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.967 ' HA ' ' HE3' ' A' ' 93' ' ' LYS . 1.0 OUTLIER -55.99 -23.38 32.3 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -177.164 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.0 p -99.91 -17.37 17.62 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.9 m -105.53 7.05 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.967 ' HE3' ' HA ' ' A' ' 90' ' ' GLU . 97.6 mttt -59.5 -41.9 90.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.086 0.47 . . . . 0.0 111.061 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.494 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 5.0 pt-20 -73.0 -24.33 60.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.161 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -72.3 -43.36 64.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.162 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.489 HG11 ' HA ' ' A' ' 51' ' ' PHE . 62.7 t -62.12 -38.64 81.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.197 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 21.8 mmt -59.62 -38.84 82.41 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.814 176.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.494 ' HG3' ' O ' ' A' ' 94' ' ' GLU . 81.7 mtt180 -59.05 -44.97 91.87 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.996 0.427 . . . . 0.0 110.773 177.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 tmtp? -66.72 -49.52 65.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.575 -178.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.26 68.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.72 -176.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.493 ' O ' ' HB3' ' A' ' 104' ' ' LYS . 41.7 mt -64.58 -36.14 83.26 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -177.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.571 ' HG2' ' HG3' ' A' ' 106' ' ' GLU . 70.8 ttt180 -65.09 -53.62 42.7 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.784 177.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.44 -32.93 67.4 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.99 0.424 . . . . 0.0 110.82 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.497 ' HA ' HG22 ' A' ' 37' ' ' ILE . 58.7 tttp -54.51 -52.78 60.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.958 175.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -82.42 -30.92 29.85 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.605 ' HA ' ' NH2' ' A' ' 112' ' ' ARG . 28.6 mm-40 -63.46 -49.15 74.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.59 0.233 . . . . 0.0 111.604 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.623 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 79.6 mm-40 -74.47 -20.88 59.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -175.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -116.1 105.02 12.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.808 0.337 . . . . 0.0 111.17 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.54 -27.75 69.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.194 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.445 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.5 mp0 -57.17 -51.27 70.0 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.69 175.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 67.2 mt -73.05 -39.18 66.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.958 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.605 ' NH2' ' HA ' ' A' ' 106' ' ' GLU . 35.1 ttm-85 -57.9 -44.73 86.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.856 0.36 . . . . 0.0 110.569 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.27 -41.26 94.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.806 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 5' ' ' ALA . 57.8 tp -62.53 -41.83 99.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.54 178.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 62.0 tp -65.16 -40.25 94.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.892 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.478 HD21 ' HB2' ' A' ' 156' ' ' LEU . 43.3 mt -81.05 -6.41 58.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.772 0.32 . . . . 0.0 111.042 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.486 ' HB1' ' H ' ' A' ' 8' ' ' ILE . . . -85.31 -31.99 22.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.069 177.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.9 p -72.9 -21.82 60.84 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.211 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.531 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -52.48 139.0 39.29 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.439 178.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.53 ' HD2' HG21 ' A' ' 11' ' ' VAL . 41.2 Cg_endo -100.1 40.66 4.16 Favored 'Cis proline' 0 CA--C 1.534 0.519 0 C-N-CA 124.371 -1.095 . . . . 0.0 113.241 -0.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.59 ' HB2' ' HB ' ' A' ' 15' ' ' THR . . . -66.77 154.69 40.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.302 0.572 . . . . 0.0 112.108 -177.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.31 119.21 23.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.61 179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 23.3 mt -86.31 112.78 21.73 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.804 0.335 . . . . 0.0 110.67 -176.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.8 t -129.13 127.24 65.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.073 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -97.55 129.19 44.71 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -91.22 77.36 5.95 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.579 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -77.57 86.22 3.9 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.966 -177.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -76.62 -18.25 58.71 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.769 -175.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -90.53 -29.88 17.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.622 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.441 ' O ' ' HB ' ' A' ' 127' ' ' THR . 8.9 t70 -145.51 138.87 26.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.816 -172.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.532 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -99.86 86.01 3.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 176.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -151.7 -34.87 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.954 -177.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.652 ' HB3' HD22 ' A' ' 145' ' ' LEU . 71.1 m95 -119.12 -0.23 11.12 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -172.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -155.39 -120.83 0.72 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 119.631 -1.271 . . . . 0.0 113.19 -172.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.516 ' HB2' ' HA2' ' A' ' 139' ' ' GLY . 1.2 p-10 -105.54 -10.21 17.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.957 0.408 . . . . 0.0 110.83 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 72.2 12.32 76.03 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.52 174.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 80.2 19.57 69.17 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.879 -178.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -163.42 19.21 0.07 Allowed 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . 0.516 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 79.86 -0.44 82.49 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 120.579 -0.82 . . . . 0.0 114.306 174.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -138.2 72.02 1.4 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.445 0.623 . . . . 0.0 110.121 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.532 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -129.07 15.15 5.88 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.558 -172.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.401 ' C ' ' H ' ' A' ' 144' ' ' ARG . 33.0 tttm 68.17 80.35 0.2 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.0 0.905 . . . . 0.0 110.523 179.197 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.38 5.33 1.81 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 114.363 -1.29 . . . . 0.0 110.906 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.659 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 24.5 ttt180 -48.09 -26.83 2.0 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.201 0.6 . . . . 0.0 112.576 -176.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 133' ' ' TRP . 37.6 tp -64.22 -48.57 75.35 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.058 0.456 . . . . 0.0 110.108 178.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -64.76 -29.05 74.21 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.549 177.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -70.2 -38.8 75.4 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 176.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.659 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 89.5 mt -58.26 -49.82 75.77 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.249 0.547 . . . . 0.0 109.531 174.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.49 HD21 HD13 ' A' ' 101' ' ' LEU . 96.4 mt -65.21 -31.3 72.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.881 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.6 tpp -61.92 -53.04 61.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.085 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -69.26 -33.97 74.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.538 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.428 ' O ' ' HG2' ' A' ' 155' ' ' GLN . 61.7 tp -60.74 -46.14 91.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.058 0.456 . . . . 0.0 110.071 175.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.531 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 54.0 ttp85 -58.83 -49.54 77.32 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.029 177.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.466 ' O ' HG13 ' A' ' 158' ' ' ILE . 44.4 mt-10 -71.66 -32.04 67.47 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -176.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 152' ' ' LEU . 9.3 pt20 -71.66 -32.19 67.64 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.427 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.478 ' HB2' HD21 ' A' ' 116' ' ' LEU . 84.5 mt -73.78 -25.81 60.32 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.462 ' O ' ' HB3' ' A' ' 160' ' ' LYS . . . -72.18 -43.64 64.24 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.055 173.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.508 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 87.2 mt -62.91 -42.91 98.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 175.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -58.14 -31.35 67.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.107 175.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.987 ' HA ' ' HE3' ' A' ' 160' ' ' LYS . 0.4 OUTLIER -66.86 -40.28 87.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.929 177.26 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.32 -23.31 65.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.666 177.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 158' ' ' ILE . 22.7 mm-40 -85.57 10.93 11.79 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.167 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.51 128.57 36.79 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.284 0.564 . . . . 0.0 111.638 -178.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -159.31 -23.09 0.07 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.518 178.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.439 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 5.1 m170 -125.6 80.07 1.87 Allowed 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 178.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.439 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 67.9 t60 -178.33 -101.28 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.225 171.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -155.55 -65.29 0.12 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -179.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 . . . . . 0 C--O 1.244 0.814 0 CA-C-N 115.095 -0.957 . . . . 0.0 108.475 171.336 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.8 mtp . . . . . 0 N--CA 1.48 1.038 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.29 162.87 39.38 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.196 1.931 . . . . 0.0 111.213 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.5 t -76.17 -32.76 23.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 4' ' ' ARG . 24.8 ttp85 60.23 54.02 4.19 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.19 178.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.1 77.66 4.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.228 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -75.48 116.99 16.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.953 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -100.5 135.46 41.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.333 -177.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.9 mt -63.26 145.52 13.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 173.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 -56.15 -54.36 46.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.365 0.602 . . . . 0.0 109.472 -178.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -167.87 139.64 3.0 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.292 174.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.405 HG21 ' HD2' ' A' ' 120' ' ' PRO . 35.0 m -59.46 146.7 9.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.277 0.56 . . . . 0.0 111.308 -179.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.4 mtm -94.14 22.66 5.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.391 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 68.42 -70.05 0.14 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.549 -173.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -77.9 44.79 0.48 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.88 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.9 m -97.75 113.32 25.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.625 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.7 mt -111.41 105.75 19.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 176.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 71.3 mt -92.67 102.02 13.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.728 -173.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.601 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 6.2 p30 -103.19 133.94 47.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.674 177.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -140.39 141.54 35.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.035 -175.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.668 ' O ' ' HB2' ' A' ' 21' ' ' SER . 6.6 t80 -150.27 100.22 2.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.182 165.083 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.668 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 6.0 t 150.19 110.7 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 124.85 1.344 . . . . 0.0 108.013 179.186 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.693 ' HA ' ' HA3' ' A' ' 27' ' ' GLY . 2.9 m -74.43 -70.26 0.41 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.1 m 47.46 -92.57 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.805 0.842 . . . . 0.0 113.087 174.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -157.24 27.27 0.3 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.524 0.678 . . . . 0.0 109.246 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.409 ' HA ' ' NH2' ' A' ' 4' ' ' ARG . 3.6 t70 -117.94 -153.16 0.52 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.166 -173.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -66.84 -1.31 3.78 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.018 0.437 . . . . 0.0 111.165 177.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.693 ' HA3' ' HA ' ' A' ' 22' ' ' THR . . . -65.48 -0.45 6.29 Favored Glycine 0 C--O 1.225 -0.44 0 CA-C-N 115.749 -0.66 . . . . 0.0 113.504 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -56.48 -26.87 55.53 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 117.296 0.548 . . . . 0.0 111.315 175.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -66.55 -24.91 66.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.625 177.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.4 m -69.41 128.97 38.44 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 174.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 -76.09 10.52 1.89 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -172.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -95.01 2.2 55.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.223 0.535 . . . . 0.0 109.65 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.24 129.76 41.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.872 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.439 ' HA ' HG23 ' A' ' 46' ' ' THR . . . -86.8 62.89 7.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.414 0.626 . . . . 0.0 111.037 -174.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -102.15 125.51 36.36 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.563 175.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -61.61 116.78 3.65 Favored 'Trans proline' 0 C--O 1.239 0.563 0 C-N-CA 122.377 2.051 . . . . 0.0 111.119 174.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.586 HG22 ' HA ' ' A' ' 104' ' ' LYS . 26.1 pt -116.94 132.77 65.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.963 -178.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.548 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 5.0 tppp? -91.76 103.85 16.36 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 177.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.7 t -121.31 115.21 45.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.676 -177.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 64.64 14.82 9.3 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.568 176.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 114.57 -12.56 20.96 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.114 177.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -110.43 143.86 40.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 117.282 0.541 . . . . 0.0 111.564 -177.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.7 m -92.72 103.62 15.97 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.189 178.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.512 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 66.4 m95 -91.18 134.29 30.18 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.512 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 5.1 Cg_exo -76.44 -1.36 11.42 Favored 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 123.05 2.5 . . . . 0.0 112.743 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.439 HG23 ' HA ' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -169.73 150.31 3.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.202 -178.704 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.9 m -58.1 -40.68 81.78 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.318 0.386 . . . . 0.0 110.426 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.464 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 14.4 tp10 -57.68 -31.32 66.23 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.511 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.453 ' HE2' HG13 ' A' ' 68' ' ' VAL . 10.2 m80 -64.96 -43.9 91.15 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 122.074 -0.391 . . . . 0.0 111.138 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -72.3 -35.28 68.62 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 177.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.571 ' CD2' ' HE3' ' A' ' 55' ' ' LYS . 1.7 t80 -60.3 -46.5 89.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.557 177.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.601 ' OE1' ' HA3' ' A' ' 78' ' ' GLY . 79.2 mm-40 -57.88 -46.19 85.25 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.444 175.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.95 -33.4 68.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.521 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.42 ' HB3' ' HZ3' ' A' ' 89' ' ' TRP . 1.6 tp-100 -92.13 -14.58 28.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.741 -178.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.571 ' HE3' ' CD2' ' A' ' 51' ' ' PHE . 91.8 mttt -67.73 -38.52 83.65 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.044 0.45 . . . . 0.0 111.141 178.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -110.45 139.41 45.7 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.844 -174.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.847 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.8 pt? -89.53 -7.87 53.99 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.626 -175.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -73.03 138.83 46.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.949 0.404 . . . . 0.0 110.714 -177.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -72.0 -39.48 69.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.781 -175.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -82.86 -36.03 25.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.793 0.33 . . . . 0.0 110.54 -174.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.526 ' O ' HG12 ' A' ' 65' ' ' ILE . 4.9 t80 -66.52 -37.66 85.51 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.138 178.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 38.4 ttp-105 -66.78 -37.62 84.93 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.662 0.744 . . . . 0.0 109.696 174.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 67' ' ' ARG . 34.0 tt0 -63.27 -33.19 74.97 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.294 175.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.421 ' OE2' ' HD2' ' A' ' 67' ' ' ARG . 5.7 tp10 -69.25 -36.1 76.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.965 177.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.526 HG12 ' O ' ' A' ' 61' ' ' TYR . 50.3 mm -60.66 -34.11 57.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.391 176.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -65.36 -32.92 74.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.973 175.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 63' ' ' GLU . 45.9 mtt180 -81.7 -33.2 31.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.789 -172.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.453 HG13 ' HE2' ' A' ' 49' ' ' HIS . 7.2 p -68.8 112.57 3.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.351 0.596 . . . . 0.0 111.482 -176.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.6 m -71.98 -40.38 68.63 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.01 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 19.4 m -81.45 132.95 54.07 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.719 -173.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 70' ' ' SER . 20.9 Cg_exo -67.03 -44.18 5.52 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 123.179 2.586 . . . . 0.0 112.943 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.3 tpt -67.63 -36.8 81.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.753 0.311 . . . . 0.0 110.947 -173.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 67.2 t -62.71 -43.15 98.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.304 178.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.28 -43.43 91.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.399 177.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.64 -39.9 95.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.891 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.466 ' HD3' ' C ' ' A' ' 76' ' ' ARG . 1.9 tmt_? -61.52 -53.88 50.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.711 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -74.48 -15.61 60.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.777 0.322 . . . . 0.0 111.178 -176.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.601 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -93.94 -5.32 62.69 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.341 175.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 44.2 ttt180 -98.79 -5.84 30.44 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -81.54 118.92 23.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.686 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 34.0 ttm105 -92.95 66.73 4.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.503 0.668 . . . . 0.0 110.604 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 95.0 p -138.69 8.0 2.56 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.707 0.765 . . . . 0.0 109.06 167.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -99.99 160.05 28.22 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.535 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.46 101.61 0.54 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.151 1.9 . . . . 0.0 111.509 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 69.0 mt -77.5 136.82 38.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.899 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.54 ' HB3' ' HB2' ' A' ' 89' ' ' TRP . 16.8 ttt180 -66.98 131.81 46.64 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.425 ' HA ' ' HD2' ' A' ' 87' ' ' LYS . 20.1 tptp -62.9 -52.15 64.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.813 -172.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -89.64 20.34 4.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.501 0.191 . . . . 0.0 111.279 -177.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.54 ' HB2' ' HB3' ' A' ' 86' ' ' ARG . 63.7 t-105 -59.8 -33.35 71.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.947 0.403 . . . . 0.0 110.167 177.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.18 -40.65 77.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.333 179.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.5 p -85.82 -9.77 56.51 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -174.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.42 HG22 ' HA ' ' A' ' 89' ' ' TRP . 34.5 m -119.24 -4.43 10.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -176.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -53.21 -44.35 67.95 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.042 0.448 . . . . 0.0 111.676 -176.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 94' ' ' GLU . 5.6 pt-20 -83.28 -20.36 34.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.294 -175.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -75.43 -43.55 49.2 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 61.0 t -64.07 -41.89 93.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.99 177.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 52.6 tpp -58.51 -47.28 84.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.709 175.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -61.48 -42.78 99.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.954 -178.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.7 tttp -65.89 -45.36 82.3 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.817 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.55 -41.99 92.37 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.951 0.405 . . . . 0.0 110.73 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.474 ' HB3' HD22 ' A' ' 152' ' ' LEU . 17.5 mt -58.62 -48.65 80.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.309 177.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.9 ttt85 -58.97 -40.92 86.22 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.711 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.23 -37.15 82.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.126 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.586 ' HA ' HG22 ' A' ' 37' ' ' ILE . 27.1 ttpp -65.69 -42.69 90.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.64 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.603 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 82.3 m-85 -82.5 -24.12 34.32 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -77.74 -41.25 38.33 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 121.867 -0.521 . . . . 0.0 111.112 176.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.728 HE21 ' N ' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -83.31 -11.06 58.11 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.513 -176.276 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -129.24 105.25 8.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.048 0.451 . . . . 0.0 109.937 173.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.49 -30.32 70.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.025 -174.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -69.49 -34.2 73.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.814 0.34 . . . . 0.0 110.397 -179.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 36.2 mt -73.0 -38.19 66.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.611 177.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.603 ' HB2' ' O ' ' A' ' 105' ' ' PHE . 22.7 ttm180 -59.8 -46.36 89.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.178 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.09 97.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.843 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.6 tp -58.13 -50.92 71.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.465 176.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 51.3 tp -58.74 -51.29 70.59 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.546 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.497 HD21 ' HB2' ' A' ' 156' ' ' LEU . 31.3 mt -68.5 -22.33 64.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.604 -174.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -78.26 -11.91 59.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.842 -178.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 68.8 p -80.52 -29.07 37.24 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.944 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 120' ' ' PRO . . . -50.84 135.18 27.66 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.951 -178.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 68.9 Cg_endo -100.45 27.18 15.21 Favored 'Cis proline' 0 N--CA 1.458 -0.562 0 C-N-CA 124.338 -1.109 . . . . 0.0 113.2 0.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -58.57 150.94 21.67 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 120.92 0.39 . . . . 0.0 111.725 -177.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -87.29 117.71 26.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.49 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 31.6 mt -88.04 127.4 35.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.07 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.601 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 1.8 p -142.85 119.18 5.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.211 0.529 . . . . 0.0 111.007 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -91.57 131.52 36.93 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -91.99 77.13 5.43 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 119.544 -0.862 . . . . 0.0 108.767 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.73 86.13 5.35 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.544 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -85.96 -15.62 40.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.073 -176.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -82.98 -25.43 32.27 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.204 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -152.05 129.65 11.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.594 -176.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.51 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -100.03 85.71 3.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.867 -178.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -158.96 -26.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -177.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.523 ' HB3' HD22 ' A' ' 145' ' ' LEU . 49.1 m95 -131.52 22.01 4.72 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -168.01 -134.27 1.69 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 119.319 -1.42 . . . . 0.0 113.695 -177.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -76.09 -34.45 59.52 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.076 0.465 . . . . 0.0 111.095 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.52 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 79.67 -2.4 73.5 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.651 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 84.93 9.91 79.8 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 121.277 -0.487 . . . . 0.0 112.499 179.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . 0.467 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 30.0 p80 -168.19 23.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.525 0.203 . . . . 0.0 111.103 -178.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 88.14 -51.45 4.0 Favored Glycine 0 CA--C 1.522 0.473 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.591 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.467 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 95.1 mttt -84.53 62.64 7.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.697 0.761 . . . . 0.0 110.655 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.52 ' HA3' ' HA3' ' A' ' 136' ' ' GLY . . . -123.41 15.25 8.13 Favored Glycine 0 C--N 1.315 -0.627 0 CA-C-N 115.221 -0.899 . . . . 0.0 112.548 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' A' ' 142' ' ' LYS . 11.1 mptt 63.02 71.33 0.52 Allowed 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 122.962 0.505 . . . . 0.0 111.506 172.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.561 ' OD1' HG23 ' A' ' 124' ' ' VAL . 6.3 t30 -71.92 5.71 2.47 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.284 -178.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.469 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 2.6 mpt_? -49.89 -22.05 1.37 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -179.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.523 HD22 ' HB3' ' A' ' 133' ' ' TRP . 62.8 tp -59.23 -45.5 90.98 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.613 0.244 . . . . 0.0 110.598 175.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.604 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -63.52 -30.83 78.77 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.751 176.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -71.77 -36.97 70.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 98.2 mt -62.14 -36.79 82.86 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 174.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.34 -38.81 92.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.337 174.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.604 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 58.1 mtt -64.04 -46.53 84.01 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 177.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -56.54 -51.08 69.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.583 177.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.474 HD22 ' HB3' ' A' ' 101' ' ' LEU . 56.4 tp -63.55 -48.42 77.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.879 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -56.77 -41.07 76.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.872 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.445 ' O ' HG13 ' A' ' 158' ' ' ILE . 1.4 tp10 -61.39 -52.54 64.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.151 -178.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -65.34 -35.48 81.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.53 -175.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.497 ' HB2' HD21 ' A' ' 116' ' ' LEU . 87.4 mt -72.47 -35.01 68.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.856 0.36 . . . . 0.0 110.317 179.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.411 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -68.43 -47.85 66.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.506 177.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 154' ' ' GLU . 73.4 mt -62.24 -37.95 79.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.422 179.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -63.3 -31.8 73.05 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.34 0.59 . . . . 0.0 110.09 177.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -82.77 -12.27 57.64 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.716 179.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 157' ' ' ALA . 7.8 mp -96.51 -35.55 11.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.839 177.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.25 -37.02 79.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.874 -177.177 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.469 ' HB2' ' HB2' ' A' ' 167' ' ' HIS . 9.4 p80 -74.18 0.33 14.34 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.85 -174.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -61.81 -31.53 71.77 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.187 0.518 . . . . 0.0 109.797 177.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -117.08 -64.95 1.24 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.473 0.654 . . . . 0.0 109.471 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -80.12 98.17 7.18 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.872 -176.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . 0.469 ' HB2' ' HB2' ' A' ' 163' ' ' HIS . 34.3 t-80 177.81 -29.22 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.012 179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 . . . . . 0 C--O 1.246 0.912 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.474 179.664 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.478 0.955 0 CA-C-O 120.596 0.236 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.88 95.56 0.97 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.337 2.025 . . . . 0.0 111.255 175.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.457 ' HA ' ' CG ' ' A' ' 25' ' ' ASP . 56.8 t -55.69 113.93 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.955 -174.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.42 HH21 ' CG ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -83.65 86.45 7.12 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 173.908 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.64 76.55 10.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.066 -175.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -85.7 84.21 7.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.267 0.556 . . . . 0.0 109.706 176.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -95.05 106.91 18.95 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.675 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 21.1 mt -80.44 83.39 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.281 -171.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -70.87 -19.12 62.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.412 0.625 . . . . 0.0 109.807 176.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -107.96 71.53 0.81 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.626 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 5.5 m -83.47 149.62 4.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 171.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.429 ' HB2' ' H ' ' A' ' 13' ' ' GLN . 0.6 OUTLIER -66.21 -80.21 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.072 -176.645 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.429 ' H ' ' HB2' ' A' ' 12' ' ' MET . 49.2 tt0 -169.32 83.38 0.13 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 173.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.3 t70 62.9 99.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.968 0.793 . . . . 0.0 110.114 -173.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.9 t -120.56 148.08 44.33 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.63 HG13 ' HD2' ' A' ' 122' ' ' LYS . 3.9 mp -86.34 104.74 14.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.968 0.413 . . . . 0.0 110.049 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.6 mt -90.03 89.93 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-O 121.281 0.562 . . . . 0.0 109.881 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 5.4 p30 -84.16 102.06 12.3 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 171.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -100.7 137.27 39.32 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.625 -171.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -150.72 -179.34 7.18 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.578 175.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 48.2 m 66.48 93.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.671 0.748 . . . . 0.0 110.666 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.439 HG21 ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -81.39 3.41 24.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.962 -176.025 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 m -46.12 -47.47 17.39 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.348 -0.842 . . . . 0.0 113.255 -175.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.42 ' CG ' HH21 ' A' ' 4' ' ' ARG . 2.6 p-10 -115.11 -175.47 2.7 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.921 -0.487 . . . . 0.0 110.996 -179.478 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.457 ' CG ' ' HA ' ' A' ' 3' ' ' VAL . 5.0 m-20 -66.35 -26.39 67.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.915 -172.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -70.05 -15.57 63.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.292 0.568 . . . . 0.0 110.277 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -87.17 -0.27 85.3 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.222 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.87 -25.78 63.64 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -56.95 -25.83 58.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.7 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.3 m -70.3 141.85 52.3 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.949 0.404 . . . . 0.0 110.486 177.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -59.06 -33.34 70.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.221 0.534 . . . . 0.0 110.971 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -85.96 20.86 2.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.31 -173.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.439 ' HA ' HG21 ' A' ' 22' ' ' THR . . . -70.21 138.65 51.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.787 0.327 . . . . 0.0 111.144 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.541 ' HA ' HG22 ' A' ' 46' ' ' THR . . . -94.53 64.86 3.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.384 -175.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -117.17 122.87 30.65 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.992 174.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.14 127.66 24.91 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 122.864 2.376 . . . . 0.0 112.532 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.543 ' CG2' ' HA ' ' A' ' 104' ' ' LYS . 11.6 pt -123.9 141.61 43.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.053 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -102.57 87.83 3.09 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.472 HG22 ' HB3' ' A' ' 103' ' ' ALA . 16.0 t -108.41 130.07 61.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.838 -173.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 t70 64.87 26.39 12.87 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.777 0.673 . . . . 0.0 110.159 175.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 77.69 14.36 82.49 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.147 -178.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.9 mttp -125.46 148.71 48.73 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -176.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 35.9 m -93.16 126.46 38.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.702 0.287 . . . . 0.0 111.193 -178.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.446 ' HB2' HG13 ' A' ' 37' ' ' ILE . 35.4 m95 -125.59 133.55 24.99 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.322 178.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 44' ' ' TRP . 11.9 Cg_exo -71.08 -29.95 16.98 Favored 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 122.763 2.309 . . . . 0.0 112.433 178.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.541 HG22 ' HA ' ' A' ' 34' ' ' ALA . 4.8 p -145.92 169.63 18.22 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.326 -177.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 m -69.42 -44.99 70.24 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.4 0.437 . . . . 0.0 111.971 -173.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.412 ' CD ' ' HG1' ' A' ' 46' ' ' THR . 0.4 OUTLIER -67.35 -15.17 63.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -173.814 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.413 ' O ' HG21 ' A' ' 65' ' ' ILE . 10.5 m80 -63.55 -52.18 62.21 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 174.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -65.96 -37.01 84.9 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.148 0.499 . . . . 0.0 109.931 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.53 -50.11 70.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.424 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -69.84 -37.03 76.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.382 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.597 ' HB1' ' HG3' ' A' ' 62' ' ' ARG . . . -62.83 -54.49 38.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.058 -175.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -73.63 -26.88 60.98 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.804 0.335 . . . . 0.0 110.417 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -56.07 -45.41 79.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.358 172.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -76.09 124.25 27.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.98 176.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.841 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.0 OUTLIER -81.05 -15.64 55.52 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.775 179.552 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -78.01 126.23 30.52 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 62' ' ' ARG . 10.7 tp10 -67.22 -38.17 84.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.504 -173.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.412 ' O ' ' HB3' ' A' ' 63' ' ' GLU . 41.7 mttm -83.41 -25.4 31.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -175.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.534 ' OH ' ' HE3' ' A' ' 83' ' ' LYS . 0.3 OUTLIER -80.82 -23.28 39.32 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.355 -0.938 . . . . 0.0 109.918 173.785 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.597 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 24.9 ttp180 -68.98 -35.58 76.89 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 167.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.412 ' HB3' ' O ' ' A' ' 60' ' ' LYS . 42.1 tt0 -64.83 -36.24 83.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.037 174.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.433 ' CD ' HH21 ' A' ' 67' ' ' ARG . 5.9 tp10 -58.93 -42.89 90.83 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.434 173.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.413 HG21 ' O ' ' A' ' 49' ' ' HIS . 45.6 mm -60.35 -37.13 73.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.979 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -72.15 -32.11 66.59 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.028 0.442 . . . . 0.0 110.415 175.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.433 HH21 ' CD ' ' A' ' 64' ' ' GLU . 35.1 ttp180 -70.57 -26.5 63.56 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.177 -175.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.2 m -87.49 121.97 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 121.485 0.66 . . . . 0.0 110.987 178.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.0 p -83.33 -13.42 55.12 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 173.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.9 m -85.89 117.48 68.8 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.455 -176.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.64 -46.62 0.82 Allowed 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 123.056 2.504 . . . . 0.0 111.954 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.9 tpt -62.51 -33.07 74.15 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.295 -176.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 93.9 t -69.29 -43.36 81.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.199 178.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.71 -38.74 92.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.619 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.99 -45.97 86.64 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.864 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 76' ' ' ARG . 42.4 mtm180 -62.59 -48.22 80.37 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.634 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.777 ' HA ' ' HB2' ' A' ' 80' ' ' ASP . 26.6 ptt? -75.47 -11.06 59.96 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.458 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.32 -32.01 65.56 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.284 -0.726 . . . . 0.0 111.284 169.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -96.64 11.13 36.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.613 0.244 . . . . 0.0 110.918 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.777 ' HB2' ' HA ' ' A' ' 77' ' ' MET . 28.1 t70 -67.2 -19.54 65.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.738 -175.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 74.29 -41.29 0.47 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.653 0.781 . . . . 0.0 111.966 177.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.8 m -83.06 33.15 0.44 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.183 0.516 . . . . 0.0 111.176 -178.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.534 ' HE3' ' OH ' ' A' ' 61' ' ' TYR . 47.4 mmtm -123.32 158.78 57.38 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.698 -178.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.18 103.04 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.603 2.202 . . . . 0.0 112.754 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 83' ' ' LYS . 73.7 mt -105.55 154.49 20.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.978 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.563 ' HB2' ' HB2' ' A' ' 89' ' ' TRP . 52.7 mtt180 -99.03 136.27 39.24 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.88 0.371 . . . . 0.0 110.866 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -60.95 -33.7 73.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.855 175.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -95.91 11.45 33.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.99 -176.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 86' ' ' ARG . 61.8 t-105 -63.92 -33.58 76.04 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.479 -174.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.82 -23.52 66.7 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.921 0.391 . . . . 0.0 110.681 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.7 m -91.87 -46.05 8.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.235 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.78 2.36 5.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.662 0.268 . . . . 0.0 111.705 -175.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 89' ' ' TRP . 35.1 ttmt -55.75 -53.64 54.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.597 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -62.46 -35.0 77.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.089 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -66.63 -51.59 54.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.696 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.2 t -64.31 -40.57 89.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.29 178.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.481 ' HA ' ' CE ' ' A' ' 97' ' ' MET . 2.1 tpt -59.29 -48.85 80.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.677 178.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 44.5 ttp180 -62.48 -35.85 80.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.321 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -64.04 -45.57 88.26 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.153 0.501 . . . . 0.0 110.248 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.52 -42.98 95.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.549 177.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 97' ' ' MET . 92.8 mt -62.05 -36.16 80.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.156 178.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.518 ' HG3' HD11 ' A' ' 152' ' ' LEU . 59.2 ttp85 -62.63 -49.17 76.23 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.186 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.508 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . -66.83 -29.75 69.76 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.185 0.517 . . . . 0.0 110.236 -178.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.543 ' HA ' ' CG2' ' A' ' 37' ' ' ILE . 57.5 tttp -59.91 -59.18 5.83 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.296 177.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.51 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 90.2 m-85 -80.07 -40.54 27.43 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.542 ' HA ' ' HD3' ' A' ' 112' ' ' ARG . 2.4 tm-20 -69.73 -37.99 76.69 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 121.154 -0.219 . . . . 0.0 111.385 -173.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.1 tp-100 -65.05 -35.74 82.14 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.045 0.45 . . . . 0.0 110.552 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -108.83 101.45 10.56 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.91 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -53.25 -34.42 57.08 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 112.077 -175.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.78 -44.91 86.56 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.068 177.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 68.1 mt -73.73 -38.87 64.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.525 -177.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.702 ' HG3' HD13 ' A' ' 156' ' ' LEU . 41.9 ttp180 -62.15 -47.98 82.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.531 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.81 -34.67 77.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.023 0.44 . . . . 0.0 110.391 178.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 50.5 tp -63.29 -41.62 98.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.15 177.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 32.2 tp -63.49 -49.25 74.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.304 178.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.98 -19.16 65.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.556 -178.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.29 11.21 12.68 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.5 0.555 . . . . 0.0 112.5 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 75.7 p -101.41 -25.39 13.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.887 0.375 . . . . 0.0 110.762 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.443 ' HB2' ' HD2' ' A' ' 153' ' ' ARG . . . -51.33 137.99 28.91 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.691 -178.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.44 ' HA ' ' HA ' ' A' ' 119' ' ' ALA . 90.2 Cg_endo -99.41 31.25 11.35 Favored 'Cis proline' 0 N--CA 1.458 -0.567 0 C-N-CA 124.276 -1.135 . . . . 0.0 113.306 -0.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.23 154.44 38.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.764 0.316 . . . . 0.0 111.274 -178.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.63 ' HD2' HG13 ' A' ' 16' ' ' ILE . 61.4 mttp -80.01 134.55 36.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.075 179.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.458 ' O ' ' HA3' ' A' ' 146' ' ' GLY . 80.8 mt -102.97 113.69 27.37 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.125 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.51 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 26.6 t -131.95 116.25 29.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.503 -178.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -78.87 111.99 15.58 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 174.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.616 ' CE1' ' HA2' ' A' ' 137' ' ' GLY . 86.4 t60 -91.61 77.27 5.68 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -177.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.473 HG23 ' O ' ' A' ' 127' ' ' THR . 10.4 t -83.63 92.08 7.59 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 122.328 1.061 . . . . 0.0 109.106 177.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -79.96 59.22 3.14 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.189 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -144.48 -51.55 0.29 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.584 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -153.67 128.91 9.75 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.184 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.575 ' HB1' ' HA2' ' A' ' 141' ' ' GLY . . . -76.76 105.47 7.84 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.068 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -151.03 -46.14 0.12 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 120.642 -0.423 . . . . 0.0 112.128 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.702 ' HB3' HD22 ' A' ' 145' ' ' LEU . 7.8 m95 -126.54 35.19 4.68 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -176.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -172.31 -123.1 0.69 Allowed Glycine 0 CA--C 1.506 -0.519 0 C-N-CA 119.237 -1.459 . . . . 0.0 112.87 -177.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.518 ' HB2' ' HA2' ' A' ' 139' ' ' GLY . 1.5 p-10 -107.13 -17.11 14.25 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.308 0.575 . . . . 0.0 109.576 176.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.424 ' HA3' ' HB2' ' A' ' 131' ' ' ALA . . . 64.6 18.94 64.32 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.773 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.616 ' HA2' ' CE1' ' A' ' 126' ' ' HIS . . . 86.11 10.89 74.01 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.042 -0.599 . . . . 0.0 113.303 -179.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -163.72 23.08 0.08 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 117.453 0.627 . . . . 0.0 112.206 -178.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . 0.518 ' HA2' ' HB2' ' A' ' 135' ' ' ASP . . . 81.65 -49.82 4.13 Favored Glycine 0 CA--C 1.524 0.611 0 C-N-CA 120.86 -0.686 . . . . 0.0 113.703 176.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -81.14 60.24 4.2 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.642 0.734 . . . . 0.0 110.275 -175.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.575 ' HA2' ' HB1' ' A' ' 131' ' ' ALA . . . -125.31 15.41 7.25 Favored Glycine 0 C--N 1.317 -0.499 0 CA-C-N 115.277 -0.874 . . . . 0.0 113.495 -179.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 67.1 mttm 70.44 79.47 0.18 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.547 0.689 . . . . 0.0 111.006 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.81 5.34 2.61 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.084 -177.504 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.479 ' O ' ' HG ' ' A' ' 148' ' ' LEU . 3.7 mmp_? -54.61 -29.96 53.32 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.702 HD22 ' HB3' ' A' ' 133' ' ' TRP . 54.2 tp -61.18 -49.91 75.29 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.051 0.453 . . . . 0.0 110.463 177.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.615 ' O ' ' HG3' ' A' ' 150' ' ' MET . . . -61.23 -32.51 80.9 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.973 177.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -72.9 -36.81 67.38 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.594 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 144' ' ' ARG . 92.6 mt -59.43 -37.23 77.55 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.57 -39.89 94.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.663 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.615 ' HG3' ' O ' ' A' ' 146' ' ' GLY . 52.9 mtt -64.73 -50.5 66.65 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.096 0.474 . . . . 0.0 110.275 177.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -60.42 -43.2 96.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.933 -178.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.518 HD11 ' HG3' ' A' ' 102' ' ' ARG . 44.8 tp -65.24 -40.84 94.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.462 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.443 ' HD2' ' HB2' ' A' ' 119' ' ' ALA . 51.6 ttp85 -56.69 -44.67 81.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.771 178.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.495 ' O ' HG13 ' A' ' 158' ' ' ILE . 26.2 tt0 -71.78 -36.05 70.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.521 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 58.3 tp60 -61.66 -43.12 99.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.089 0.471 . . . . 0.0 110.292 176.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.702 HD13 ' HG3' ' A' ' 112' ' ' ARG . 93.1 mt -71.56 -29.83 65.18 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.55 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.433 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -63.42 -38.67 92.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.375 176.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 154' ' ' GLU . 75.1 mt -57.97 -43.26 84.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.56 176.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -61.44 -40.21 93.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.169 177.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -71.87 -23.25 61.48 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.749 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . 0.433 HD13 ' O ' ' A' ' 157' ' ' ALA . 5.0 mp -79.09 -40.54 30.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.191 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.767 ' HB2' ' HD2' ' A' ' 164' ' ' HIS . 44.5 mt-10 -84.95 -18.51 34.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.089 0.471 . . . . 0.0 110.631 177.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 64.29 14.91 9.07 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.227 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . 0.767 ' HD2' ' HB2' ' A' ' 162' ' ' GLU . 18.3 p80 -73.39 126.83 31.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.044 0.449 . . . . 0.0 110.315 -177.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -97.67 158.25 15.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.566 -177.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -152.41 163.78 38.83 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.935 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -89.81 -38.65 13.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.681 0.277 . . . . 0.0 111.3 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.76 -179.604 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.405 ' HG3' ' O ' ' A' ' 1' ' ' MET . 22.6 ptt? . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 121.072 0.463 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -72.13 -34.67 7.87 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.877 2.385 . . . . 0.0 111.668 175.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -137.11 136.05 47.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.374 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -87.24 89.63 8.06 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.412 ' O ' HD13 ' A' ' 114' ' ' LEU . . . -92.43 -67.26 0.87 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.078 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.82 108.39 3.93 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -177.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -140.68 -6.7 1.13 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.917 179.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 48.7 mm -108.99 99.58 8.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.236 0.541 . . . . 0.0 110.632 -175.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -81.97 -35.46 28.97 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.571 177.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -172.73 120.94 0.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.078 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.541 HG21 ' HD2' ' A' ' 120' ' ' PRO . 5.7 m -72.0 135.43 27.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.051 0.453 . . . . 0.0 110.636 175.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.59 14.06 1.8 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.83 -176.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 69.77 159.54 0.19 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.468 0.707 . . . . 0.0 111.053 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 51.03 29.72 4.8 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.382 0.611 . . . . 0.0 110.99 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.4 m -86.87 124.28 32.92 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.281 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 56.3 mt -110.66 115.48 49.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 169.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.2 mt -89.81 106.16 16.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.233 0.539 . . . . 0.0 110.286 -176.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.6 ' HA ' ' O ' ' A' ' 124' ' ' VAL . 8.0 t-20 -106.65 126.86 52.82 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.591 -177.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.455 ' O ' ' HG3' ' A' ' 125' ' ' GLU . 27.2 p90 -128.78 -175.15 3.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.912 -178.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -142.19 104.72 4.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.11 -177.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 79.7 p 53.92 -166.33 0.08 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.622 0.769 . . . . 0.0 112.207 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.712 ' O ' ' HA3' ' A' ' 27' ' ' GLY . 0.2 OUTLIER -81.71 -59.45 2.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.998 0.428 . . . . 0.0 110.232 178.66 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t 59.26 -96.34 0.06 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.444 175.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -144.24 -67.91 0.33 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.016 0.436 . . . . 0.0 111.732 -175.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -81.05 -79.4 0.16 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -165.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -88.92 -1.76 58.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.192 0.52 . . . . 0.0 111.532 -171.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.712 ' HA3' ' O ' ' A' ' 22' ' ' THR . . . -66.82 -0.63 9.1 Favored Glycine 0 CA--C 1.52 0.387 0 CA-C-N 116.019 -0.537 . . . . 0.0 114.231 -175.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -50.68 -32.1 18.31 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 117.332 0.566 . . . . 0.0 111.96 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -72.58 -12.54 61.1 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 98.6 p -77.3 126.89 31.65 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.843 177.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -51.15 -23.18 3.03 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -175.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.49 ' CZ ' ' HB2' ' A' ' 71' ' ' PRO . 54.1 t80 -62.4 -62.38 1.79 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 174.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.605 ' HA ' HG21 ' A' ' 22' ' ' THR . . . 32.26 -149.7 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.272 1.029 . . . . 0.0 113.753 -176.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -166.24 66.2 0.11 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.407 177.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.503 ' O ' ' HA ' ' A' ' 46' ' ' THR . 94.6 m95 -131.1 121.65 18.83 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.629 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.52 ' HA ' ' O ' ' A' ' 44' ' ' TRP . 19.2 Cg_endo -59.4 126.55 21.08 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.854 2.37 . . . . 0.0 112.515 178.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.2 pt -119.86 157.74 22.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.155 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -119.42 95.34 4.75 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -177.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 t -131.09 142.31 43.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.174 -0.467 . . . . 0.0 109.971 -176.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.8 t70 67.14 17.06 10.35 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.817 0.818 . . . . 0.0 109.58 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 72.19 22.23 78.94 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.353 -174.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.3 tppt? -121.82 149.92 42.64 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -176.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.7 m -94.95 113.51 25.23 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.872 0.368 . . . . 0.0 110.156 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.52 ' O ' ' HA ' ' A' ' 36' ' ' PRO . 41.6 m95 -109.89 123.47 36.17 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.455 ' O ' ' HB ' ' A' ' 46' ' ' THR . 39.8 Cg_exo -58.94 -11.9 13.65 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 123.053 2.502 . . . . 0.0 113.794 -177.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 35' ' ' TRP . 8.9 t 177.57 170.11 0.63 Allowed 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 174.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -40.59 88.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -175.172 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -48.17 -42.57 30.08 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.195 0.31 . . . . 0.0 111.785 176.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -64.64 -41.86 95.85 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.181 -176.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -69.95 -43.52 71.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.215 0.531 . . . . 0.0 110.179 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.444 ' HA ' HG11 ' A' ' 96' ' ' VAL . 89.5 t80 -61.26 -42.36 98.5 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.497 178.301 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.667 ' HG3' HD13 ' A' ' 65' ' ' ILE . 5.3 tp-100 -68.83 -45.56 70.84 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.885 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.487 ' HB1' ' CG ' ' A' ' 62' ' ' ARG . . . -65.9 -47.43 74.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.762 -177.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -75.23 -13.69 60.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.569 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.526 ' HB2' ' HZ2' ' A' ' 55' ' ' LYS . 4.9 ttmp? -59.23 -33.19 70.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.077 0.465 . . . . 0.0 110.532 171.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.546 ' CE1' ' HG3' ' A' ' 83' ' ' LYS . 56.9 m-85 -107.32 166.99 10.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.971 -176.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.741 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.5 pt? -115.08 11.37 16.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.043 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -97.15 123.22 40.85 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.225 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.15 -40.13 86.64 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.101 -173.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -60.21 -53.77 53.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.923 0.392 . . . . 0.0 110.348 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 65' ' ' ILE . 3.1 t80 -66.44 -32.81 74.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.592 -177.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.487 ' CG ' ' HB1' ' A' ' 53' ' ' ALA . 44.4 ttm-85 -60.6 -49.41 77.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.019 0.437 . . . . 0.0 110.313 178.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -78.4 -15.15 58.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.109 0.48 . . . . 0.0 110.354 -178.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -74.66 -40.31 61.51 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.667 HD13 ' HG3' ' A' ' 52' ' ' GLN . 72.0 mt -70.39 -25.81 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.124 174.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.07 -22.06 53.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.854 174.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 73.4 ttt-85 -80.99 -29.97 35.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.958 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.511 HG21 ' HB ' ' A' ' 73' ' ' VAL . 14.9 p -75.8 126.61 36.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.235 0.54 . . . . 0.0 110.736 -179.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m -74.44 -41.75 60.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.506 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.466 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 30.2 t -69.09 130.05 91.63 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.069 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.49 ' HB2' ' CZ ' ' A' ' 32' ' ' PHE . 7.2 Cg_exo -73.45 -26.07 14.6 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.592 2.194 . . . . 0.0 111.322 174.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.5 tpt -70.44 -43.27 70.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.321 -177.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.511 ' HB ' HG21 ' A' ' 68' ' ' VAL . 59.8 t -63.84 -34.09 66.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.048 177.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.14 -49.53 74.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.472 177.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.542 ' HA ' HE21 ' A' ' 52' ' ' GLN . . . -60.16 -37.42 80.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.551 177.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -62.08 -33.93 75.34 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.758 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.522 ' SD ' HG12 ' A' ' 65' ' ' ILE . 56.1 mtt -65.72 -50.69 63.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.131 0.491 . . . . 0.0 111.473 -179.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.608 ' HA3' ' OE1' ' A' ' 52' ' ' GLN . . . -94.3 4.42 70.32 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.29 -0.957 . . . . 0.0 113.568 -174.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 75' ' ' ALA . 5.3 tpp180 -71.24 -25.13 62.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.908 0.354 . . . . 0.0 111.211 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -99.37 131.97 45.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.152 0.501 . . . . 0.0 109.701 177.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.5 mtm180 -101.35 29.88 4.52 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.397 -172.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.4 p -82.7 19.73 1.27 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.574 0.702 . . . . 0.0 109.935 174.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.546 ' HG3' ' CE1' ' A' ' 56' ' ' PHE . 41.1 mmtm -89.22 169.72 12.36 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.703 178.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 16.8 Cg_endo -60.14 -29.13 88.42 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.332 2.021 . . . . 0.0 111.537 170.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.7 mt 67.72 -174.06 0.19 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.129 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.467 ' HB3' ' HB2' ' A' ' 89' ' ' TRP . 57.0 ttt-85 -134.18 142.27 47.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.811 -176.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -64.37 -68.41 0.36 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.799 -175.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -81.96 25.94 0.54 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.411 -174.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.489 ' CZ2' ' HE3' ' A' ' 55' ' ' LYS . 58.5 t-105 -61.0 -33.11 72.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.117 0.484 . . . . 0.0 110.104 177.294 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.415 ' O ' ' HE3' ' A' ' 93' ' ' LYS . 40.3 tt0 -55.92 -35.78 66.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.071 -178.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.1 p -99.93 -8.52 23.88 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -173.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.487 HG22 ' HA ' ' A' ' 89' ' ' TRP . 33.7 m -108.74 1.81 9.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -175.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.487 ' HB2' ' HZ2' ' A' ' 93' ' ' LYS . 10.0 mtmp? -54.92 -57.69 10.63 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.593 0.711 . . . . 0.0 110.49 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.543 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 1.9 pm0 -78.14 -14.94 59.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.134 -178.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.551 ' O ' ' HD3' ' A' ' 99' ' ' LYS . 34.0 tt0 -73.11 -52.37 14.5 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 176.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.444 HG11 ' HA ' ' A' ' 51' ' ' PHE . 96.8 t -58.44 -41.41 81.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.996 177.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 mmt -60.46 -39.0 86.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.281 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 38.1 ttm-85 -61.56 -38.45 87.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.524 0.202 . . . . 0.0 111.105 -178.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.551 ' HD3' ' O ' ' A' ' 95' ' ' GLN . 0.3 OUTLIER -71.03 -48.17 54.46 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.916 0.388 . . . . 0.0 110.805 176.23 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.2 -42.86 99.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.466 -177.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.6 -38.56 84.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.182 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 52.1 ttt180 -63.3 -48.17 79.2 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.06 178.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 107' ' ' GLN . . . -59.02 -38.01 78.26 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.981 0.419 . . . . 0.0 110.408 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.436 ' HZ3' HD13 ' A' ' 111' ' ' LEU . 60.4 tttm -62.11 -52.37 64.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.323 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.517 ' O ' ' HB2' ' A' ' 112' ' ' ARG . 68.5 m-85 -81.96 -41.66 20.49 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -174.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -75.42 -39.59 58.76 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 121.969 -0.457 . . . . 0.0 111.197 -173.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.414 ' HB3' ' O ' ' A' ' 103' ' ' ALA . 29.4 tt0 -74.63 -31.19 61.91 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.796 0.331 . . . . 0.0 110.662 -178.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -100.21 97.55 8.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.31 66.04 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -171.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.472 ' CD ' ' H ' ' A' ' 110' ' ' GLU . 1.7 pm0 -68.14 -32.45 72.74 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.038 -178.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.436 HD13 ' HZ3' ' A' ' 104' ' ' LYS . 42.4 mt -74.34 -37.15 63.61 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.584 ' HG3' HD13 ' A' ' 156' ' ' LEU . 24.5 ttm180 -58.23 -50.26 74.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.121 177.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.95 -39.88 95.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.724 -179.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.412 HD13 ' O ' ' A' ' 5' ' ' ALA . 58.6 tp -59.46 -48.83 80.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.583 177.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 44.1 tp -62.93 -39.61 95.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.993 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.423 HD21 ' HB2' ' A' ' 156' ' ' LEU . 80.5 mt -76.61 -15.03 59.94 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -82.97 -18.18 40.84 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.71 0.291 . . . . 0.0 111.159 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 66.2 p -72.44 -35.01 68.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.031 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.66 138.47 16.87 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.793 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.541 ' HD2' HG21 ' A' ' 11' ' ' VAL . 43.1 Cg_endo -95.72 29.16 15.96 Favored 'Cis proline' 0 CA--C 1.533 0.458 0 C-N-CA 124.147 -1.189 . . . . 0.0 113.657 1.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.19 153.32 43.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.88 0.372 . . . . 0.0 111.354 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -92.29 134.81 34.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.261 -177.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 40.1 mt -98.5 109.45 22.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.88 0.372 . . . . 0.0 110.708 -177.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.6 ' O ' ' HA ' ' A' ' 18' ' ' ASN . 91.2 t -139.41 122.72 18.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.447 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 19' ' ' PHE . 87.6 tt0 -101.31 118.19 36.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.088 0.47 . . . . 0.0 110.77 176.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.79 ' HA ' ' HB3' ' A' ' 135' ' ' ASP . 57.4 t60 -89.92 81.76 6.25 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 173.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 14.5 t -120.86 143.52 48.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.304 -178.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -118.56 9.03 12.14 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.403 0.62 . . . . 0.0 109.808 175.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -62.24 -33.33 74.38 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.468 176.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -155.52 119.0 4.41 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.472 ' HA ' ' HA2' ' A' ' 136' ' ' GLY . . . -80.73 85.51 6.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.225 0.536 . . . . 0.0 110.787 -175.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.666 ' HA ' ' O ' ' A' ' 141' ' ' GLY . 40.2 t80 179.01 153.03 0.38 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.559 -1.2 . . . . 0.0 107.911 173.144 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.645 ' O ' ' HB3' ' A' ' 145' ' ' LEU . 84.1 m95 78.73 -19.19 0.46 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.557 0.743 . . . . 0.0 111.537 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' A' ' 143' ' ' ASN . . . -138.04 -152.82 6.12 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.373 -174.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.79 ' HB3' ' HA ' ' A' ' 126' ' ' HIS . 20.4 t70 -67.46 -24.86 65.65 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.156 0.503 . . . . 0.0 110.802 178.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.536 ' HA3' ' HA3' ' A' ' 141' ' ' GLY . . . 72.51 8.32 71.09 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.506 178.357 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 88.17 -10.66 70.13 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.408 -0.425 . . . . 0.0 113.103 178.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . 0.605 ' CE1' ' HB2' ' A' ' 140' ' ' LYS . 24.9 p80 -160.63 30.12 0.16 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.928 0.364 . . . . 0.0 111.625 -173.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 84.35 -51.37 4.55 Favored Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.813 -0.708 . . . . 0.0 113.191 177.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.605 ' HB2' ' CE1' ' A' ' 138' ' ' HIS . 53.1 mttp -75.49 55.4 0.81 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.073 0.463 . . . . 0.0 111.676 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.666 ' O ' ' HA ' ' A' ' 132' ' ' TYR . . . -123.7 -4.84 7.91 Favored Glycine 0 C--O 1.223 -0.576 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.0 176.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.405 ' C ' ' H ' ' A' ' 144' ' ' ARG . 2.9 mptp? 61.4 84.2 0.14 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.962 0.381 . . . . 0.0 111.722 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.437 ' HA ' ' HA2' ' A' ' 134' ' ' GLY . 8.0 t30 -68.08 5.73 0.87 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.412 1.085 . . . . 0.0 111.597 -178.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.405 ' H ' ' C ' ' A' ' 142' ' ' LYS . 14.0 tpt180 -33.06 -31.05 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.542 1.137 . . . . 0.0 113.276 176.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.645 ' HB3' ' O ' ' A' ' 133' ' ' TRP . 25.5 tp -68.23 -49.23 62.12 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 117.944 0.338 . . . . 0.0 110.957 -179.268 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -61.47 -32.54 81.51 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.251 -0.74 . . . . 0.0 111.251 177.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -69.01 -43.25 75.17 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 175.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.5 -48.79 76.44 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.439 175.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.82 -42.08 88.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.892 178.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 73.1 mtm -69.04 -37.46 78.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.331 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -60.57 -51.63 68.59 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.705 0.288 . . . . 0.0 110.253 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 156' ' ' LEU . 64.3 tp -60.11 -43.07 95.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.416 178.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.441 HH21 ' HA ' ' A' ' 120' ' ' PRO . 2.4 ttt-85 -51.85 -56.95 10.92 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.676 177.352 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.472 ' O ' HG13 ' A' ' 158' ' ' ILE . 35.8 mt-10 -72.86 -22.98 60.69 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.213 -178.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -68.57 -39.14 81.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.222 174.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.584 HD13 ' HG3' ' A' ' 112' ' ' ARG . 96.0 mt -67.93 -31.25 70.87 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.108 0.48 . . . . 0.0 109.892 179.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.575 ' O ' HD13 ' A' ' 161' ' ' LEU . . . -67.38 -46.08 74.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.34 175.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 154' ' ' GLU . 85.2 mt -65.72 -34.39 70.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -59.67 -34.35 72.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.303 0.573 . . . . 0.0 109.943 175.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.757 ' HA ' ' HD2' ' A' ' 163' ' ' HIS . 26.9 ttpp -79.14 -18.81 52.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.667 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . 0.575 HD13 ' O ' ' A' ' 157' ' ' ALA . 6.1 mp -78.43 -25.06 45.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.114 0.483 . . . . 0.0 110.619 176.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -84.07 11.26 8.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.324 178.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.757 ' HD2' ' HA ' ' A' ' 160' ' ' LYS . 3.5 m-70 -61.49 93.68 0.04 OUTLIER 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 173.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -103.69 41.21 1.31 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.223 0.535 . . . . 0.0 110.217 -174.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.447 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 49.3 t-80 -77.91 14.93 0.97 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.666 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.447 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 11.9 m170 68.35 -172.16 0.19 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.317 0.579 . . . . 0.0 110.888 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -145.19 103.88 3.9 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.123 173.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 . . . . . 0 C--O 1.245 0.856 0 CA-C-O 118.343 -0.837 . . . . 0.0 109.586 -173.635 . . . . . . . . 0 0 . 1 stop_ save_