data_2cjn_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 2cjn _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 full ' A' A ' 1' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 3' ' ' TYR . . . . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.705 -0.48 . . . . 2.68 109.705 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.455 HG23 ' HB3' ' A' ' 18' ' ' ASP . 0.2 OUTLIER -44.53 100.71 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.058 -1.057 . . . . 1.34 109.53 -179.093 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.623 ' CD2' ' N ' ' A' ' 84' ' ' SER . 22.9 m-85 -76.75 129.68 36.64 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 116.036 -0.529 . . . . 1.22 109.672 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.96 96.98 1.78 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.219 -0.926 . . . . 3.64 108.666 179.206 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.474 HG21 ' O ' ' A' ' 3' ' ' TYR . 5.5 t -96.07 119.58 44.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 O-C-N 121.557 -0.715 . . . . 0.66 109.524 -179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.508 ' CG2' ' N ' ' A' ' 7' ' ' LEU . 3.5 m -93.25 161.01 14.58 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.285 -0.884 . . . . 1.07 110.093 -179.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.508 ' N ' ' CG2' ' A' ' 6' ' ' THR . 33.9 mt -134.24 92.8 2.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.681 -0.859 . . . . 1.29 108.681 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.47 ' CG1' HD22 ' A' ' 89' ' ' LEU . 54.0 t -72.07 111.48 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.186 -0.946 . . . . 0.62 109.906 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.466 ' HD2' ' OG1' ' A' ' 90' ' ' THR . 14.2 mmm-85 -99.75 127.16 34.67 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.335 -0.853 . . . . 1.93 109.076 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.461 ' HG3' ' HB3' ' A' ' 91' ' ' ASN . 35.6 Cg_endo -78.54 7.03 4.4 Favored 'Trans proline' 0 C--N 1.311 -1.445 0 C-N-CA 122.383 2.055 . . . . 1.18 110.563 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -110.97 -39.12 4.89 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.249 -0.907 . . . . 2.66 109.552 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -118.2 -68.64 0.35 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.518 -1.433 . . . . 2.56 109.518 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 177.74 -173.33 0.13 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.304 -1.115 . . . . 2.4 109.438 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.464 ' HA ' ' HA ' ' A' ' 8' ' ' VAL . 6.8 pt-20 -83.14 173.04 12.04 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.228 -0.92 . . . . 2.49 109.654 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -169.96 123.82 0.74 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.295 -0.878 . . . . 1.02 109.381 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 9.8 m -92.7 133.61 35.84 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.96 109.888 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.517 HD11 ' CG2' ' A' ' 19' ' ' VAL . 1.1 pt -130.96 145.68 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.307 -0.871 . . . . 0.73 108.912 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.467 ' C ' ' CG2' ' A' ' 19' ' ' VAL . 3.0 m-20 -72.12 137.52 47.09 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.149 -0.969 . . . . 1.45 109.726 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.517 ' CG2' HD11 ' A' ' 17' ' ' ILE . 3.8 t -156.43 130.85 4.99 Favored Pre-proline 0 N--CA 1.488 1.47 0 O-C-N 121.33 -0.857 . . . . 1.24 109.278 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.528 ' HG2' ' CG ' ' A' ' 23' ' ' GLU . 35.8 Cg_endo -78.41 170.08 19.01 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.404 2.069 . . . . 0.5 110.54 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.443 ' HB3' ' CE2' ' A' ' 3' ' ' TYR . 0.2 OUTLIER -79.49 -0.53 33.62 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.846 . . . . 2.86 109.703 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.31 22.66 12.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.113 -0.992 . . . . 0.92 110.007 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.528 ' CG ' ' HG2' ' A' ' 20' ' ' PRO . 17.6 mm-40 -140.81 128.14 21.11 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.082 -1.011 . . . . 2.09 109.605 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.683 ' CE1' ' CE2' ' A' ' 81' ' ' TYR . 36.4 m-85 -54.49 143.83 22.98 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.426 -0.796 . . . . 1.07 109.742 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.479 HG22 HD11 ' A' ' 88' ' ' ILE . 4.7 mp -66.28 -36.91 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.167 -0.958 . . . . 1.9 108.979 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.525 ' HB2' ' CG2' ' A' ' 77' ' ' THR . 8.2 tt -66.01 -9.69 32.73 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.459 -0.776 . . . . 1.68 109.366 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -82.63 -41.21 19.75 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 1.77 109.773 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.416 ' O ' HG11 ' A' ' 28' ' ' VAL . 99.1 t -85.52 -28.18 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.152 -0.967 . . . . 0.89 109.613 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.545 ' HA ' HD13 ' A' ' 34' ' ' LEU . . . -76.74 -35.2 57.93 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.369 -0.832 . . . . 0.55 109.042 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 30' ' ' GLU . 26.4 tt0 -73.03 3.12 5.78 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.192 -0.943 . . . . 2.35 109.046 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -110.01 -27.58 9.14 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.177 -0.952 . . . . 2.3 109.176 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 68.7 mm-40 -87.33 1.7 52.5 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -0.881 . . . . 1.74 109.398 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.447 ' C ' HD22 ' A' ' 34' ' ' LEU . . . 85.34 39.95 8.13 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.731 -1.748 . . . . 1.35 108.731 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.551 ' N ' HD22 ' A' ' 34' ' ' LEU . 5.4 mt -91.47 21.04 4.81 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.501 -0.999 . . . . 2.88 109.724 -179.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.523 ' C ' ' O ' ' A' ' 34' ' ' LEU . 5.2 t0 26.26 71.9 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 115.734 -0.666 . . . . 2.31 110.63 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.527 ' CD1' ' HB1' ' A' ' 29' ' ' ALA . 16.0 mt -95.34 149.14 35.74 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.102 -0.999 . . . . 1.32 109.623 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.549 ' HG2' ' HA ' ' A' ' 48' ' ' CYS . 30.9 Cg_endo -79.91 163.5 23.23 Favored 'Trans proline' 0 C--N 1.307 -1.614 0 C-N-CA 122.804 2.336 . . . . 0.47 111.154 -179.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.515 ' HB3' ' O ' ' A' ' 37' ' ' PRO . 17.6 p90 172.26 155.13 0.08 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.77 -0.826 . . . . 0.78 108.77 179.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.444 ' OG ' HG23 ' A' ' 47' ' ' THR . 74.5 m -151.1 -58.82 0.17 Allowed 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.323 -0.86 . . . . 0.76 109.301 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.51 ' SG ' ' CB ' ' A' ' 45' ' ' CYS . 7.6 p -83.02 -28.27 29.75 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.58 -0.7 . . . . 1.12 109.234 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.555 ' HD3' ' HB2' ' A' ' 78' ' ' CYS . 16.3 tpp85 51.81 22.1 1.61 Allowed 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 106.989 -1.486 . . . . 0.84 106.989 -178.019 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.442 ' N ' ' C ' ' A' ' 40' ' ' CYS . . . -126.63 -5.87 6.37 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.686 -0.634 . . . . 0.75 110.039 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.541 ' O ' ' CB ' ' A' ' 64' ' ' PHE . . . 87.53 -9.45 73.49 Favored Glycine 0 N--CA 1.483 1.822 0 N-CA-C 107.201 -2.36 . . . . 0.34 107.201 -177.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.4 ' C ' ' HB2' ' A' ' 64' ' ' PHE . . . -73.22 -0.58 14.74 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.678 -0.896 . . . . 0.51 109.774 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.51 ' CB ' ' SG ' ' A' ' 40' ' ' CYS . 5.1 t -138.62 172.51 12.77 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.125 -0.984 . . . . 0.92 109.622 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.54 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -122.16 1.91 9.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.219 -0.926 . . . . 1.23 109.717 -179.903 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.505 HG21 ' N ' ' A' ' 48' ' ' CYS . 0.6 OUTLIER -46.01 -37.92 7.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.073 -1.017 . . . . 0.93 109.136 179.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.549 ' HA ' ' HG2' ' A' ' 37' ' ' PRO . 23.2 p -99.29 78.47 2.22 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.562 -0.903 . . . . 0.9 108.562 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.436 ' HB1' ' O ' ' A' ' 46' ' ' SER . . . -136.96 137.65 39.73 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.155 -0.966 . . . . 0.7 110.244 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.528 ' CA ' ' O ' ' A' ' 89' ' ' LEU . . . -117.68 -116.07 2.77 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.019 -1.633 . . . . 0.78 109.019 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.499 ' CD ' ' CD ' ' A' ' 95' ' ' GLU . 38.7 tttt 177.17 87.73 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.123 -1.222 . . . . 2.2 110.005 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.546 ' CD2' HG13 ' A' ' 88' ' ' ILE . 0.3 OUTLIER -58.15 102.64 0.11 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 2.29 109.161 179.409 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.546 ' CD1' ' CD1' ' A' ' 89' ' ' LEU . 9.2 mt -87.62 -36.71 17.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.219 -0.926 . . . . 1.91 109.521 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.503 ' O ' ' CD1' ' A' ' 52' ' ' LEU . 1.3 mm-40 -130.67 137.85 49.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.256 -0.903 . . . . 2.92 109.804 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.453 ' HA3' ' CB ' ' A' ' 86' ' ' CYS . . . 105.96 -144.73 15.85 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.487 -1.445 . . . . 0.75 109.487 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.496 ' O ' HG11 ' A' ' 57' ' ' VAL . 2.6 tt0 -158.77 157.74 32.25 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -1.136 . . . . 2.69 109.342 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.496 HG11 ' O ' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -157.38 150.85 8.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 108.507 -0.923 . . . . 1.06 108.507 -179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.58 62.97 6.78 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.662 -1.274 . . . . 1.16 109.22 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.502 ' CB ' HG22 ' A' ' 75' ' ' VAL . 0.2 OUTLIER -81.88 4.99 20.33 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.187 -0.946 . . . . 2.15 109.828 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.4 m -90.29 37.4 0.9 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.095 -1.003 . . . . 1.61 109.049 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.46 ' O ' ' O ' ' A' ' 62' ' ' GLN . 19.6 t70 -122.23 -35.53 3.12 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.38 -0.825 . . . . 1.32 110.51 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.572 ' CB ' ' CD1' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -52.06 -172.04 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.012 -1.055 . . . . 2.09 110.222 -178.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.2 t -126.26 -0.85 7.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.441 -0.787 . . . . 2.13 109.587 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 43' ' ' GLY . 26.8 t80 -103.93 -30.09 10.54 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.116 -0.99 . . . . 0.65 110.042 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.593 ' CD1' ' CD2' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -95.23 150.39 20.28 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.085 -1.009 . . . . 1.87 109.824 -179.512 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.464 ' O ' HD11 ' A' ' 70' ' ' ILE . 7.1 m-20 -136.89 -167.24 2.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.366 -0.834 . . . . 1.95 109.297 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.47 -11.64 25.32 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.168 -0.957 . . . . 1.73 109.562 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -77.37 -71.15 0.43 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.204 -0.935 . . . . 1.36 109.523 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.493 ' CG ' HD13 ' A' ' 96' ' ' LEU . 12.0 mp0 -55.9 -43.93 77.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.711 -1.218 . . . . 2.21 107.711 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.464 HD11 ' O ' ' A' ' 66' ' ' ASP . 20.6 mt -49.88 -36.67 11.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 O-C-N 121.469 -0.77 . . . . 0.91 108.982 179.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.81 -43.43 85.69 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.912 . . . . 2.36 109.698 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.587 ' HB2' ' CE2' ' A' ' 74' ' ' PHE . 8.6 mptt -65.97 -22.58 66.48 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 121.536 -0.727 . . . . 2.15 109.066 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.463 ' O ' ' O ' ' A' ' 74' ' ' PHE . . . 111.08 1.41 28.38 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.833 -1.307 . . . . 0.45 109.833 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.599 ' CZ ' ' HB2' ' A' ' 96' ' ' LEU . 52.6 m-85 -51.8 -172.9 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.169 -1.195 . . . . 0.64 110.32 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.59 ' CG2' ' CB ' ' A' ' 80' ' ' ALA . 1.5 p 167.5 96.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.301 -0.874 . . . . 1.66 109.338 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.593 ' CD2' ' CD1' ' A' ' 65' ' ' LEU . 41.7 mt -43.71 108.93 0.12 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.248 -0.908 . . . . 0.52 109.413 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.525 ' CG2' ' HB2' ' A' ' 26' ' ' LEU . 0.6 OUTLIER -64.62 -47.53 78.25 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.379 -0.826 . . . . 1.1 110.221 -179.515 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . 0.555 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 13.6 p -52.58 -20.0 2.7 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.093 -1.005 . . . . 1.01 110.131 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.578 ' HA ' ' CD1' ' A' ' 24' ' ' TYR . 2.8 p -143.76 42.42 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.032 -1.043 . . . . 0.77 110.069 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.59 ' CB ' ' CG2' ' A' ' 75' ' ' VAL . . . -123.08 129.57 51.65 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.033 -1.042 . . . . 0.56 109.541 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.683 ' CE2' ' CE1' ' A' ' 24' ' ' TYR . 66.0 m-85 -98.68 155.07 37.13 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.478 -0.764 . . . . 0.98 109.598 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.48 ' HA ' ' CG1' ' A' ' 57' ' ' VAL . 56.0 Cg_endo -89.86 114.49 0.57 Allowed 'Trans proline' 0 C--N 1.293 -2.368 0 N-CA-C 107.126 -1.913 . . . . 0.33 107.126 177.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.529 ' O ' ' CB ' ' A' ' 84' ' ' SER . 14.5 mmt180 -86.14 11.04 12.72 Favored 'General case' 0 C--N 1.288 -2.097 0 N-CA-C 107.137 -1.431 . . . . 3.08 107.137 178.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.623 ' N ' ' CD2' ' A' ' 3' ' ' TYR . 0.4 OUTLIER 160.95 162.53 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.867 -0.733 . . . . 1.47 109.312 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.456 ' N ' ' HB3' ' A' ' 3' ' ' TYR . 7.8 p-10 -45.71 129.85 9.1 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.143 -0.973 . . . . 2.08 108.483 179.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.453 ' CB ' ' HA3' ' A' ' 55' ' ' GLY . 27.6 p -154.47 -164.4 1.82 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.916 -1.115 . . . . 0.66 110.438 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.46 ' HD3' HG22 ' A' ' 8' ' ' VAL . 14.2 ttmt -146.95 101.74 3.45 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.39 -0.967 . . . . 1.82 108.39 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.546 HG13 ' CD2' ' A' ' 52' ' ' LEU . 18.8 mt -87.75 103.05 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.195 -0.941 . . . . 0.94 110.739 -178.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.546 ' CD1' ' CD1' ' A' ' 53' ' ' LEU . 0.5 OUTLIER -59.62 95.67 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.467 -0.771 . . . . 1.18 110.044 179.362 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.499 ' CG2' ' HB3' ' A' ' 7' ' ' LEU . 1.5 p -66.04 157.96 29.62 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.263 -0.898 . . . . 0.69 108.72 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.461 ' HB3' ' HG3' ' A' ' 10' ' ' PRO . 3.9 m-20 63.5 105.08 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.015 -1.053 . . . . 1.67 109.361 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.47 ' HB3' ' OE2' ' A' ' 95' ' ' GLU . 64.4 mm-40 -152.36 51.01 0.77 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.281 -0.887 . . . . 1.57 109.299 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.547 ' HG3' ' CZ ' ' A' ' 97' ' ' TYR . 2.4 tt0 -86.16 45.71 1.25 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.315 -0.866 . . . . 2.39 109.518 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.456 ' CG ' ' C ' ' A' ' 93' ' ' GLU . 15.7 mt-10 -153.69 -36.71 0.1 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.187 -0.946 . . . . 2.39 109.927 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.591 ' CG ' ' CZ ' ' A' ' 74' ' ' PHE . 5.0 pt-20 -82.46 -9.22 59.52 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.067 -1.021 . . . . 1.89 108.779 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.599 ' HB2' ' CZ ' ' A' ' 74' ' ' PHE . 1.1 tt -99.45 18.37 17.97 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.524 -0.735 . . . . 1.73 109.017 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.655 ' N ' ' CD1' ' A' ' 97' ' ' TYR . 19.2 m-85 . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 117.985 -1.007 . . . . 4.02 110.603 -178.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 3' ' ' TYR . . . . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.705 -0.48 . . . . 2.6800000000000002 109.705 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 1' ' ' ALA . 0.2 OUTLIER -44.53 100.71 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.058 -1.057 . . . . 0.96999999999999997 109.53 -179.093 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.623 ' CD2' ' N ' ' A' ' 84' ' ' SER . 22.9 m-85 -76.75 129.68 36.64 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 116.036 -0.529 . . . . 0.38 109.672 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.96 96.98 1.78 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.219 -0.926 . . . . 3.02 108.666 179.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.962 HG11 HG12 ' A' ' 25' ' ' ILE . 5.5 t -96.07 119.58 44.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 O-C-N 121.557 -0.715 . . . . 0.40000000000000002 109.524 -179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.523 ' O ' HD23 ' A' ' 7' ' ' LEU . 3.5 m -93.25 161.01 14.58 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.285 -0.884 . . . . 0.5 110.093 -179.563 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.645 HD22 HG22 ' A' ' 90' ' ' THR . 33.9 mt -134.24 92.8 2.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.681 -0.859 . . . . 0.64000000000000001 108.681 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.48 ' HA ' ' HA ' ' A' ' 14' ' ' GLU . 54.0 t -72.07 111.48 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.186 -0.946 . . . . 0.44 109.906 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.463 ' HD2' ' OG1' ' A' ' 90' ' ' THR . 14.2 mmm-85 -99.75 127.16 34.67 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.335 -0.853 . . . . 1.5600000000000001 109.076 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.51 ' HG3' ' HB3' ' A' ' 91' ' ' ASN . 35.6 Cg_endo -78.54 7.03 4.4 Favored 'Trans proline' 0 C--N 1.311 -1.445 0 C-N-CA 122.383 2.055 . . . . 0.98999999999999999 110.563 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -110.97 -39.12 4.89 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.249 -0.907 . . . . 2.6600000000000001 109.552 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -118.2 -68.64 0.35 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.518 -1.433 . . . . 2.0699999999999998 109.518 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER 177.74 -173.33 0.13 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.304 -1.115 . . . . 2.0699999999999998 109.438 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.48 ' HA ' ' HA ' ' A' ' 8' ' ' VAL . 6.8 pt-20 -83.14 173.04 12.04 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.228 -0.92 . . . . 2.4900000000000002 109.654 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -169.96 123.82 0.74 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.295 -0.878 . . . . 0.47999999999999998 109.381 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 9.8 m -92.7 133.61 35.84 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.58999999999999997 109.888 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.961 HG21 HD11 ' A' ' 34' ' ' LEU . 1.1 pt -130.96 145.68 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.307 -0.871 . . . . 0.46999999999999997 108.912 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.629 ' O ' HG11 ' A' ' 28' ' ' VAL . 3.0 m-20 -72.12 137.52 47.09 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.149 -0.969 . . . . 1.45 109.726 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.702 ' CG2' HD12 ' A' ' 17' ' ' ILE . 3.8 t -156.43 130.85 4.99 Favored Pre-proline 0 N--CA 1.488 1.47 0 O-C-N 121.33 -0.857 . . . . 0.84999999999999998 109.278 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.553 ' HG2' ' CG ' ' A' ' 23' ' ' GLU . 35.8 Cg_endo -78.41 170.08 19.01 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.404 2.069 . . . . 0.40999999999999998 110.54 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.456 ' HB3' ' CE2' ' A' ' 3' ' ' TYR . 0.2 OUTLIER -79.49 -0.53 33.62 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.846 . . . . 2.8599999999999999 109.703 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.31 22.66 12.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.113 -0.992 . . . . 0.92000000000000004 110.007 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.553 ' CG ' ' HG2' ' A' ' 20' ' ' PRO . 17.6 mm-40 -140.81 128.14 21.11 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.082 -1.011 . . . . 2.0899999999999999 109.605 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.683 ' CE1' ' CE2' ' A' ' 81' ' ' TYR . 36.4 m-85 -54.49 143.83 22.98 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.426 -0.796 . . . . 0.54000000000000004 109.742 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.962 HG12 HG11 ' A' ' 5' ' ' VAL . 4.7 mp -66.28 -36.91 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.167 -0.958 . . . . 1.3 108.979 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.783 HD23 ' O ' ' A' ' 26' ' ' LEU . 8.2 tt -66.01 -9.69 32.73 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.459 -0.776 . . . . 0.97999999999999998 109.366 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -82.63 -41.21 19.75 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 1.77 109.773 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.629 HG11 ' O ' ' A' ' 18' ' ' ASP . 99.1 t -85.52 -28.18 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.152 -0.967 . . . . 0.52000000000000002 109.613 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.716 ' CB ' HD12 ' A' ' 34' ' ' LEU . . . -76.74 -35.2 57.93 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.369 -0.832 . . . . 0.55000000000000004 109.042 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.464 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 26.4 tt0 -73.03 3.12 5.78 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.192 -0.943 . . . . 2.3500000000000001 109.046 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -110.01 -27.58 9.14 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.177 -0.952 . . . . 2.2999999999999998 109.176 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 68.7 mm-40 -87.33 1.7 52.5 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -0.881 . . . . 1.74 109.398 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.457 ' C ' HD23 ' A' ' 34' ' ' LEU . . . 85.34 39.95 8.13 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.731 -1.748 . . . . 1.1200000000000001 108.731 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.961 HD11 HG21 ' A' ' 17' ' ' ILE . 5.4 mt -91.47 21.04 4.81 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.501 -0.999 . . . . 1.9199999999999999 109.724 -179.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.523 ' C ' ' O ' ' A' ' 34' ' ' LEU . 5.2 t0 26.26 71.9 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 115.734 -0.666 . . . . 2.3100000000000001 110.63 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.624 HD12 ' HB3' ' A' ' 29' ' ' ALA . 16.0 mt -95.34 149.14 35.74 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.102 -0.999 . . . . 0.96999999999999997 109.623 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.561 ' HG2' ' HA ' ' A' ' 48' ' ' CYS . 30.9 Cg_endo -79.91 163.5 23.23 Favored 'Trans proline' 0 C--N 1.307 -1.614 0 C-N-CA 122.804 2.336 . . . . 0.41999999999999998 111.154 -179.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.517 ' HB3' ' O ' ' A' ' 37' ' ' PRO . 17.6 p90 172.26 155.13 0.08 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.77 -0.826 . . . . 0.65000000000000002 108.77 179.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.434 ' OG ' HG21 ' A' ' 47' ' ' THR . 74.5 m -151.1 -58.82 0.17 Allowed 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.323 -0.86 . . . . 0.47999999999999998 109.301 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.51 ' SG ' ' CB ' ' A' ' 45' ' ' CYS . 7.6 p -83.02 -28.27 29.75 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.58 -0.7 . . . . 0.39000000000000001 109.234 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.604 ' HD3' ' HB2' ' A' ' 78' ' ' CYS . 16.3 tpp85 51.81 22.1 1.61 Allowed 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 106.989 -1.486 . . . . 0.71999999999999997 106.989 -178.019 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.442 ' N ' ' C ' ' A' ' 40' ' ' CYS . . . -126.63 -5.87 6.37 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.686 -0.634 . . . . 0.33000000000000002 110.039 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.616 ' HA2' HD13 ' A' ' 76' ' ' LEU . . . 87.53 -9.45 73.49 Favored Glycine 0 N--CA 1.483 1.822 0 N-CA-C 107.201 -2.36 . . . . 0.34000000000000002 107.201 -177.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.41 ' C ' ' HB2' ' A' ' 64' ' ' PHE . . . -73.22 -0.58 14.74 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.678 -0.896 . . . . 0.37 109.774 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.51 ' CB ' ' SG ' ' A' ' 40' ' ' CYS . 5.1 t -138.62 172.51 12.77 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.125 -0.984 . . . . 0.45000000000000001 109.622 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.557 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -122.16 1.91 9.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.219 -0.926 . . . . 1.02 109.717 -179.903 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.463 ' CG2' ' N ' ' A' ' 48' ' ' CYS . 0.6 OUTLIER -46.01 -37.92 7.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.073 -1.017 . . . . 0.51000000000000001 109.136 179.929 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.561 ' HA ' ' HG2' ' A' ' 37' ' ' PRO . 23.2 p -99.29 78.47 2.22 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.562 -0.903 . . . . 0.47999999999999998 108.562 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -136.96 137.65 39.73 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.155 -0.966 . . . . 0.69999999999999996 110.244 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.528 ' CA ' ' O ' ' A' ' 89' ' ' LEU . . . -117.68 -116.07 2.77 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.019 -1.633 . . . . 0.75 109.019 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.783 ' HE2' HD21 ' A' ' 53' ' ' LEU . 38.7 tttt 177.17 87.73 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.123 -1.222 . . . . 1.6100000000000001 110.005 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.896 HD21 ' SG ' ' A' ' 86' ' ' CYS . 0.3 OUTLIER -58.15 102.64 0.11 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 1.71 109.161 179.409 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 1.055 ' CD1' HD12 ' A' ' 89' ' ' LEU . 9.2 mt -87.62 -36.71 17.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.219 -0.926 . . . . 1.5700000000000001 109.521 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.767 ' O ' HD11 ' A' ' 52' ' ' LEU . 1.3 mm-40 -130.67 137.85 49.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.256 -0.903 . . . . 2.9199999999999999 109.804 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.468 ' HA3' ' HB3' ' A' ' 86' ' ' CYS . . . 105.96 -144.73 15.85 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.487 -1.445 . . . . 0.56999999999999995 109.487 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.419 ' HB3' ' HB2' ' A' ' 83' ' ' ARG . 2.6 tt0 -158.77 157.74 32.25 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -1.136 . . . . 2.6899999999999999 109.342 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.695 HG12 ' HA ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -157.38 150.85 8.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 108.507 -0.923 . . . . 0.59999999999999998 108.507 -179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.58 62.97 6.78 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.662 -1.274 . . . . 1.1599999999999999 109.22 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.611 ' NE2' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -81.88 4.99 20.33 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.187 -0.946 . . . . 2.1499999999999999 109.828 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.4 m -90.29 37.4 0.9 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.095 -1.003 . . . . 1.25 109.049 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.46 ' O ' ' O ' ' A' ' 62' ' ' GLN . 19.6 t70 -122.23 -35.53 3.12 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.38 -0.825 . . . . 1.3200000000000001 110.51 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 1.105 ' CB ' HD12 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -52.06 -172.04 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.012 -1.055 . . . . 2.0899999999999999 110.222 -178.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.2 t -126.26 -0.85 7.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.441 -0.787 . . . . 1.5600000000000001 109.587 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.557 ' CE1' ' HB3' ' A' ' 46' ' ' SER . 26.8 t80 -103.93 -30.09 10.54 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.116 -0.99 . . . . 0.56999999999999995 110.042 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.829 HD13 ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -95.23 150.39 20.28 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.085 -1.009 . . . . 1.3 109.824 -179.512 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.613 ' O ' HD12 ' A' ' 70' ' ' ILE . 7.1 m-20 -136.89 -167.24 2.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.366 -0.834 . . . . 1.95 109.297 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.47 -11.64 25.32 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.168 -0.957 . . . . 1.73 109.562 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -77.37 -71.15 0.43 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.204 -0.935 . . . . 1.3600000000000001 109.523 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.641 ' CG ' HD11 ' A' ' 96' ' ' LEU . 12.0 mp0 -55.9 -43.93 77.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.711 -1.218 . . . . 2.0800000000000001 107.711 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.613 HD12 ' O ' ' A' ' 66' ' ' ASP . 20.6 mt -49.88 -36.67 11.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 O-C-N 121.469 -0.77 . . . . 0.64000000000000001 108.982 179.181 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.81 -43.43 85.69 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.912 . . . . 2.3599999999999999 109.698 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.61 ' HB2' ' CE2' ' A' ' 74' ' ' PHE . 8.6 mptt -65.97 -22.58 66.48 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 121.536 -0.727 . . . . 1.3100000000000001 109.066 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.463 ' O ' ' O ' ' A' ' 74' ' ' PHE . . . 111.08 1.41 28.38 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.833 -1.307 . . . . 0.40999999999999998 109.833 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.633 ' CG ' HD12 ' A' ' 96' ' ' LEU . 52.6 m-85 -51.8 -172.9 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.169 -1.195 . . . . 0.64000000000000001 110.32 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.651 ' CG2' ' HB1' ' A' ' 80' ' ' ALA . 1.5 p 167.5 96.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.301 -0.874 . . . . 1.1899999999999999 109.338 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.105 HD12 ' CB ' ' A' ' 62' ' ' GLN . 41.7 mt -43.71 108.93 0.12 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.248 -0.908 . . . . 0.37 109.413 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.542 HG22 ' HB2' ' A' ' 26' ' ' LEU . 0.6 OUTLIER -64.62 -47.53 78.25 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.379 -0.826 . . . . 0.51000000000000001 110.221 -179.515 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' CYS . . . . . 0.604 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 13.6 p -52.58 -20.0 2.7 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.093 -1.005 . . . . 0.58999999999999997 110.131 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.775 HG13 ' O ' ' A' ' 79' ' ' VAL . 2.8 p -143.76 42.42 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.032 -1.043 . . . . 0.55000000000000004 110.069 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.83 ' O ' HD12 ' A' ' 25' ' ' ILE . . . -123.08 129.57 51.65 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.033 -1.042 . . . . 0.45000000000000001 109.541 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.683 ' CE2' ' CE1' ' A' ' 24' ' ' TYR . 66.0 m-85 -98.68 155.07 37.13 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.478 -0.764 . . . . 0.41999999999999998 109.598 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.695 ' HA ' HG12 ' A' ' 57' ' ' VAL . 56.0 Cg_endo -89.86 114.49 0.57 Allowed 'Trans proline' 0 C--N 1.293 -2.368 0 N-CA-C 107.126 -1.913 . . . . 0.32000000000000001 107.126 177.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.529 ' O ' ' CB ' ' A' ' 84' ' ' SER . 14.5 mmt180 -86.14 11.04 12.72 Favored 'General case' 0 C--N 1.288 -2.097 0 N-CA-C 107.137 -1.431 . . . . 2.5499999999999998 107.137 178.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.623 ' N ' ' CD2' ' A' ' 3' ' ' TYR . 0.4 OUTLIER 160.95 162.53 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.867 -0.733 . . . . 0.72999999999999998 109.312 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.451 ' N ' ' HB3' ' A' ' 3' ' ' TYR . 7.8 p-10 -45.71 129.85 9.1 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.143 -0.973 . . . . 2.0800000000000001 108.483 179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.896 ' SG ' HD21 ' A' ' 52' ' ' LEU . 27.6 p -154.47 -164.4 1.82 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.916 -1.115 . . . . 0.54000000000000004 110.438 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.2 ttmt -146.95 101.74 3.45 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.39 -0.967 . . . . 1.3799999999999999 108.39 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.648 HG12 HD23 ' A' ' 52' ' ' LEU . 18.8 mt -87.75 103.05 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.195 -0.941 . . . . 0.63 110.739 -178.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 1.055 HD12 ' CD1' ' A' ' 53' ' ' LEU . 0.5 OUTLIER -59.62 95.67 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.467 -0.771 . . . . 0.54000000000000004 110.044 179.362 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.645 HG22 HD22 ' A' ' 7' ' ' LEU . 1.5 p -66.04 157.96 29.62 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.263 -0.898 . . . . 0.58999999999999997 108.72 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.51 ' HB3' ' HG3' ' A' ' 10' ' ' PRO . 3.9 m-20 63.5 105.08 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.015 -1.053 . . . . 1.6699999999999999 109.361 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.832 ' NE2' HD22 ' A' ' 89' ' ' LEU . 64.4 mm-40 -152.36 51.01 0.77 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.281 -0.887 . . . . 1.1499999999999999 109.299 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.55 ' HG3' ' CZ ' ' A' ' 97' ' ' TYR . 2.4 tt0 -86.16 45.71 1.25 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.315 -0.866 . . . . 2.3900000000000001 109.518 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.456 ' CG ' ' C ' ' A' ' 93' ' ' GLU . 15.7 mt-10 -153.69 -36.71 0.1 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.187 -0.946 . . . . 2.3900000000000001 109.927 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.607 ' HG3' ' CZ ' ' A' ' 74' ' ' PHE . 5.0 pt-20 -82.46 -9.22 59.52 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.067 -1.021 . . . . 1.8899999999999999 108.779 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.773 ' O ' HD23 ' A' ' 96' ' ' LEU . 1.1 tt -99.45 18.37 17.97 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.524 -0.735 . . . . 1.22 109.017 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.655 ' CD1' ' N ' ' A' ' 97' ' ' TYR . 19.2 m-85 . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 117.985 -1.007 . . . . 3.5299999999999998 110.603 -178.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 3' ' ' TYR . . . . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.705 -0.48 . . . . 2.6800000000000002 109.705 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 1' ' ' ALA . 0.2 OUTLIER -44.53 100.71 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.058 -1.057 . . . . 0.96999999999999997 109.53 -179.093 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.623 ' CD2' ' N ' ' A' ' 84' ' ' SER . 22.9 m-85 -76.75 129.68 36.64 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 116.036 -0.529 . . . . 0.38 109.672 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.96 96.98 1.78 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.219 -0.926 . . . . 3.02 108.666 179.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.962 HG11 HG12 ' A' ' 25' ' ' ILE . 5.5 t -96.07 119.58 44.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 O-C-N 121.557 -0.715 . . . . 0.40000000000000002 109.524 -179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.523 ' O ' HD23 ' A' ' 7' ' ' LEU . 3.5 m -93.25 161.01 14.58 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.285 -0.884 . . . . 0.5 110.093 -179.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.645 HD22 HG22 ' A' ' 90' ' ' THR . 33.9 mt -134.24 92.8 2.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.681 -0.859 . . . . 0.64000000000000001 108.681 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.48 ' HA ' ' HA ' ' A' ' 14' ' ' GLU . 54.0 t -72.07 111.48 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.186 -0.946 . . . . 0.44 109.906 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.463 ' HD2' ' OG1' ' A' ' 90' ' ' THR . 14.2 mmm-85 -99.75 127.16 34.67 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.335 -0.853 . . . . 1.5600000000000001 109.076 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.51 ' HG3' ' HB3' ' A' ' 91' ' ' ASN . 35.6 Cg_endo -78.54 7.03 4.4 Favored 'Trans proline' 0 C--N 1.311 -1.445 0 C-N-CA 122.383 2.055 . . . . 0.98999999999999999 110.563 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -110.97 -39.12 4.89 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.249 -0.907 . . . . 2.6600000000000001 109.552 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -118.2 -68.64 0.35 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.518 -1.433 . . . . 2.0699999999999998 109.518 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER 177.74 -173.33 0.13 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.304 -1.115 . . . . 2.0699999999999998 109.438 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.48 ' HA ' ' HA ' ' A' ' 8' ' ' VAL . 6.8 pt-20 -83.14 173.04 12.04 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.228 -0.92 . . . . 2.4900000000000002 109.654 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -169.96 123.82 0.74 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.295 -0.878 . . . . 0.47999999999999998 109.381 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 9.8 m -92.7 133.61 35.84 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.58999999999999997 109.888 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.961 HG21 HD11 ' A' ' 34' ' ' LEU . 1.1 pt -130.96 145.68 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.307 -0.871 . . . . 0.46999999999999997 108.912 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.629 ' O ' HG11 ' A' ' 28' ' ' VAL . 3.0 m-20 -72.12 137.52 47.09 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.149 -0.969 . . . . 1.45 109.726 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.702 ' CG2' HD12 ' A' ' 17' ' ' ILE . 3.8 t -156.43 130.85 4.99 Favored Pre-proline 0 N--CA 1.488 1.47 0 O-C-N 121.33 -0.857 . . . . 0.84999999999999998 109.278 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.553 ' HG2' ' CG ' ' A' ' 23' ' ' GLU . 35.8 Cg_endo -78.41 170.08 19.01 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.404 2.069 . . . . 0.40999999999999998 110.54 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.456 ' HB3' ' CE2' ' A' ' 3' ' ' TYR . 0.2 OUTLIER -79.49 -0.53 33.62 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.846 . . . . 2.8599999999999999 109.703 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.31 22.66 12.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.113 -0.992 . . . . 0.92000000000000004 110.007 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.553 ' CG ' ' HG2' ' A' ' 20' ' ' PRO . 17.6 mm-40 -140.81 128.14 21.11 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.082 -1.011 . . . . 2.0899999999999999 109.605 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.683 ' CE1' ' CE2' ' A' ' 81' ' ' TYR . 36.4 m-85 -54.49 143.83 22.98 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.426 -0.796 . . . . 0.54000000000000004 109.742 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.962 HG12 HG11 ' A' ' 5' ' ' VAL . 4.7 mp -66.28 -36.91 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.167 -0.958 . . . . 1.3 108.979 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.783 HD23 ' O ' ' A' ' 26' ' ' LEU . 8.2 tt -66.01 -9.69 32.73 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.459 -0.776 . . . . 0.97999999999999998 109.366 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -82.63 -41.21 19.75 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 1.77 109.773 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.629 HG11 ' O ' ' A' ' 18' ' ' ASP . 99.1 t -85.52 -28.18 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.152 -0.967 . . . . 0.52000000000000002 109.613 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.716 ' CB ' HD12 ' A' ' 34' ' ' LEU . . . -76.74 -35.2 57.93 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.369 -0.832 . . . . 0.55000000000000004 109.042 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.464 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 26.4 tt0 -73.03 3.12 5.78 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.192 -0.943 . . . . 2.3500000000000001 109.046 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -110.01 -27.58 9.14 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.177 -0.952 . . . . 2.2999999999999998 109.176 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 68.7 mm-40 -87.33 1.7 52.5 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -0.881 . . . . 1.74 109.398 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.457 ' C ' HD23 ' A' ' 34' ' ' LEU . . . 85.34 39.95 8.13 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.731 -1.748 . . . . 1.1200000000000001 108.731 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.961 HD11 HG21 ' A' ' 17' ' ' ILE . 5.4 mt -91.47 21.04 4.81 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.501 -0.999 . . . . 1.9199999999999999 109.724 -179.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.523 ' C ' ' O ' ' A' ' 34' ' ' LEU . 5.2 t0 26.26 71.9 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 115.734 -0.666 . . . . 2.3100000000000001 110.63 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.624 HD12 ' HB3' ' A' ' 29' ' ' ALA . 16.0 mt -95.34 149.14 35.74 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.102 -0.999 . . . . 0.96999999999999997 109.623 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.561 ' HG2' ' HA ' ' A' ' 48' ' ' CYS . 30.9 Cg_endo -79.91 163.5 23.23 Favored 'Trans proline' 0 C--N 1.307 -1.614 0 C-N-CA 122.804 2.336 . . . . 0.41999999999999998 111.154 -179.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.517 ' HB3' ' O ' ' A' ' 37' ' ' PRO . 17.6 p90 172.26 155.13 0.08 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.77 -0.826 . . . . 0.65000000000000002 108.77 179.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.434 ' OG ' HG21 ' A' ' 47' ' ' THR . 74.5 m -151.1 -58.82 0.17 Allowed 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.323 -0.86 . . . . 0.47999999999999998 109.301 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.51 ' SG ' ' CB ' ' A' ' 45' ' ' CYS . 7.6 p -83.02 -28.27 29.75 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.58 -0.7 . . . . 0.39000000000000001 109.234 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.604 ' HD3' ' HB2' ' A' ' 78' ' ' CYS . 16.3 tpp85 51.81 22.1 1.61 Allowed 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 106.989 -1.486 . . . . 0.71999999999999997 106.989 -178.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.442 ' N ' ' C ' ' A' ' 40' ' ' CYS . . . -126.63 -5.87 6.37 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.686 -0.634 . . . . 0.33000000000000002 110.039 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.616 ' HA2' HD13 ' A' ' 76' ' ' LEU . . . 87.53 -9.45 73.49 Favored Glycine 0 N--CA 1.483 1.822 0 N-CA-C 107.201 -2.36 . . . . 0.34000000000000002 107.201 -177.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.41 ' C ' ' HB2' ' A' ' 64' ' ' PHE . . . -73.22 -0.58 14.74 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.678 -0.896 . . . . 0.37 109.774 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.51 ' CB ' ' SG ' ' A' ' 40' ' ' CYS . 5.1 t -138.62 172.51 12.77 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.125 -0.984 . . . . 0.45000000000000001 109.622 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.557 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -122.16 1.91 9.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.219 -0.926 . . . . 1.02 109.717 -179.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.463 ' CG2' ' N ' ' A' ' 48' ' ' CYS . 0.6 OUTLIER -46.01 -37.92 7.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.073 -1.017 . . . . 0.51000000000000001 109.136 179.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.561 ' HA ' ' HG2' ' A' ' 37' ' ' PRO . 23.2 p -99.29 78.47 2.22 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.562 -0.903 . . . . 0.47999999999999998 108.562 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -136.96 137.65 39.73 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.155 -0.966 . . . . 0.69999999999999996 110.244 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.528 ' CA ' ' O ' ' A' ' 89' ' ' LEU . . . -117.68 -116.07 2.77 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.019 -1.633 . . . . 0.75 109.019 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.783 ' HE2' HD21 ' A' ' 53' ' ' LEU . 38.7 tttt 177.17 87.73 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.123 -1.222 . . . . 1.6100000000000001 110.005 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.896 HD21 ' SG ' ' A' ' 86' ' ' CYS . 0.3 OUTLIER -58.15 102.64 0.11 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 1.71 109.161 179.409 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 1.055 ' CD1' HD12 ' A' ' 89' ' ' LEU . 9.2 mt -87.62 -36.71 17.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.219 -0.926 . . . . 1.5700000000000001 109.521 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.767 ' O ' HD11 ' A' ' 52' ' ' LEU . 1.3 mm-40 -130.67 137.85 49.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.256 -0.903 . . . . 2.9199999999999999 109.804 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.468 ' HA3' ' HB3' ' A' ' 86' ' ' CYS . . . 105.96 -144.73 15.85 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.487 -1.445 . . . . 0.56999999999999995 109.487 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.419 ' HB3' ' HB2' ' A' ' 83' ' ' ARG . 2.6 tt0 -158.77 157.74 32.25 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -1.136 . . . . 2.6899999999999999 109.342 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.695 HG12 ' HA ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -157.38 150.85 8.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 108.507 -0.923 . . . . 0.59999999999999998 108.507 -179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.58 62.97 6.78 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.662 -1.274 . . . . 1.1599999999999999 109.22 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.547 ' HB2' HG23 ' A' ' 75' ' ' VAL . 0.2 OUTLIER -81.88 4.99 20.33 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.187 -0.946 . . . . 2.1499999999999999 109.828 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.4 m -90.29 37.4 0.9 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.095 -1.003 . . . . 1.25 109.049 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.46 ' O ' ' O ' ' A' ' 62' ' ' GLN . 19.6 t70 -122.23 -35.53 3.12 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.38 -0.825 . . . . 1.3200000000000001 110.51 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 1.105 ' CB ' HD12 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -52.06 -172.04 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.012 -1.055 . . . . 2.0899999999999999 110.222 -178.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.2 t -126.26 -0.85 7.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.441 -0.787 . . . . 1.5600000000000001 109.587 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.557 ' CE1' ' HB3' ' A' ' 46' ' ' SER . 26.8 t80 -103.93 -30.09 10.54 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.116 -0.99 . . . . 0.56999999999999995 110.042 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.829 HD13 ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -95.23 150.39 20.28 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.085 -1.009 . . . . 1.3 109.824 -179.512 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.613 ' O ' HD12 ' A' ' 70' ' ' ILE . 7.1 m-20 -136.89 -167.24 2.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.366 -0.834 . . . . 1.95 109.297 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.47 -11.64 25.32 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.168 -0.957 . . . . 1.73 109.562 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -77.37 -71.15 0.43 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.204 -0.935 . . . . 1.3600000000000001 109.523 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.641 ' CG ' HD11 ' A' ' 96' ' ' LEU . 12.0 mp0 -55.9 -43.93 77.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.711 -1.218 . . . . 2.0800000000000001 107.711 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.613 HD12 ' O ' ' A' ' 66' ' ' ASP . 20.6 mt -49.88 -36.67 11.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 O-C-N 121.469 -0.77 . . . . 0.64000000000000001 108.982 179.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.81 -43.43 85.69 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.912 . . . . 2.3599999999999999 109.698 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.61 ' HB2' ' CE2' ' A' ' 74' ' ' PHE . 8.6 mptt -65.97 -22.58 66.48 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 121.536 -0.727 . . . . 1.3100000000000001 109.066 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.463 ' O ' ' O ' ' A' ' 74' ' ' PHE . . . 111.08 1.41 28.38 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.833 -1.307 . . . . 0.40999999999999998 109.833 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.633 ' CG ' HD12 ' A' ' 96' ' ' LEU . 52.6 m-85 -51.8 -172.9 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.169 -1.195 . . . . 0.64000000000000001 110.32 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.651 ' CG2' ' HB1' ' A' ' 80' ' ' ALA . 1.5 p 167.5 96.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.301 -0.874 . . . . 1.1899999999999999 109.338 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.105 HD12 ' CB ' ' A' ' 62' ' ' GLN . 41.7 mt -43.71 108.93 0.12 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.248 -0.908 . . . . 0.37 109.413 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.542 HG22 ' HB2' ' A' ' 26' ' ' LEU . 0.6 OUTLIER -64.62 -47.53 78.25 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.379 -0.826 . . . . 0.51000000000000001 110.221 -179.515 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . 0.604 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 13.6 p -52.58 -20.0 2.7 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.093 -1.005 . . . . 0.58999999999999997 110.131 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.775 HG13 ' O ' ' A' ' 79' ' ' VAL . 2.8 p -143.76 42.42 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.032 -1.043 . . . . 0.55000000000000004 110.069 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.83 ' O ' HD12 ' A' ' 25' ' ' ILE . . . -123.08 129.57 51.65 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.033 -1.042 . . . . 0.45000000000000001 109.541 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.683 ' CE2' ' CE1' ' A' ' 24' ' ' TYR . 66.0 m-85 -98.68 155.07 37.13 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.478 -0.764 . . . . 0.41999999999999998 109.598 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.695 ' HA ' HG12 ' A' ' 57' ' ' VAL . 56.0 Cg_endo -89.86 114.49 0.57 Allowed 'Trans proline' 0 C--N 1.293 -2.368 0 N-CA-C 107.126 -1.913 . . . . 0.32000000000000001 107.126 177.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.529 ' O ' ' CB ' ' A' ' 84' ' ' SER . 14.5 mmt180 -86.14 11.04 12.72 Favored 'General case' 0 C--N 1.288 -2.097 0 N-CA-C 107.137 -1.431 . . . . 2.5499999999999998 107.137 178.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.623 ' N ' ' CD2' ' A' ' 3' ' ' TYR . 0.4 OUTLIER 160.95 162.53 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.867 -0.733 . . . . 0.72999999999999998 109.312 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.451 ' N ' ' HB3' ' A' ' 3' ' ' TYR . 7.8 p-10 -45.71 129.85 9.1 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.143 -0.973 . . . . 2.0800000000000001 108.483 179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.896 ' SG ' HD21 ' A' ' 52' ' ' LEU . 27.6 p -154.47 -164.4 1.82 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.916 -1.115 . . . . 0.54000000000000004 110.438 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.2 ttmt -146.95 101.74 3.45 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.39 -0.967 . . . . 1.3799999999999999 108.39 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.648 HG12 HD23 ' A' ' 52' ' ' LEU . 18.8 mt -87.75 103.05 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.195 -0.941 . . . . 0.63 110.739 -178.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 1.055 HD12 ' CD1' ' A' ' 53' ' ' LEU . 0.5 OUTLIER -59.62 95.67 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.467 -0.771 . . . . 0.54000000000000004 110.044 179.362 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.645 HG22 HD22 ' A' ' 7' ' ' LEU . 1.5 p -66.04 157.96 29.62 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.263 -0.898 . . . . 0.58999999999999997 108.72 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.51 ' HB3' ' HG3' ' A' ' 10' ' ' PRO . 3.9 m-20 63.5 105.08 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.015 -1.053 . . . . 1.6699999999999999 109.361 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.832 ' NE2' HD22 ' A' ' 89' ' ' LEU . 64.4 mm-40 -152.36 51.01 0.77 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.281 -0.887 . . . . 1.1499999999999999 109.299 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.55 ' HG3' ' CZ ' ' A' ' 97' ' ' TYR . 2.4 tt0 -86.16 45.71 1.25 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.315 -0.866 . . . . 2.3900000000000001 109.518 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.456 ' CG ' ' C ' ' A' ' 93' ' ' GLU . 15.7 mt-10 -153.69 -36.71 0.1 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.187 -0.946 . . . . 2.3900000000000001 109.927 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.607 ' HG3' ' CZ ' ' A' ' 74' ' ' PHE . 5.0 pt-20 -82.46 -9.22 59.52 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.067 -1.021 . . . . 1.8899999999999999 108.779 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.773 ' O ' HD23 ' A' ' 96' ' ' LEU . 1.1 tt -99.45 18.37 17.97 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.524 -0.735 . . . . 1.22 109.017 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.655 ' CD1' ' N ' ' A' ' 97' ' ' TYR . 19.2 m-85 . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 117.985 -1.007 . . . . 3.5299999999999998 110.603 -178.101 . . . . . . . . 1 1 . 1 stop_ save_