data_1gd4_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 1gd4 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 mmm . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.223 0.535 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 2.0 tp -130.28 135.77 27.95 Favored Pre-proline 0 N--CA 1.493 1.677 0 O-C-N 121.329 -0.857 . . . . 0.0 110.169 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.43 -166.0 0.28 Allowed 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 123.62 1.326 . . . . 0.0 110.351 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 111.09 -63.03 0.28 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.549 ' O ' ' C ' ' A' ' 6' ' ' LEU . . . 85.88 39.54 8.04 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 110.194 -1.163 . . . . 0.0 110.194 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.549 ' C ' ' O ' ' A' ' 5' ' ' GLY . 0.0 OUTLIER -43.43 120.36 1.9 Allowed 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 178.333 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.3 t -64.06 -69.82 0.26 Allowed 'General case' 0 C--N 1.274 -2.706 0 C-N-CA 119.016 -1.074 . . . . 0.0 110.681 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.427 ' O ' ' CB ' ' A' ' 9' ' ' ALA . 4.8 tp10 -134.93 -139.87 0.17 Allowed 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.264 -0.898 . . . . 0.0 111.207 -179.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.808 ' HA ' ' O ' ' A' ' 43' ' ' TYR . . . 166.28 66.86 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.533 ' HB2' ' HD2' ' A' ' 11' ' ' PRO . 1.7 ptmt -97.21 -179.13 0.83 Allowed Pre-proline 0 C--N 1.301 -1.501 0 O-C-N 121.68 -0.637 . . . . 0.0 109.856 -179.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.541 ' HA ' ' O ' ' A' ' 41' ' ' VAL . 33.1 Cg_endo -58.74 149.44 77.2 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.764 1.402 . . . . 0.0 110.808 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.451 ' N ' ' O ' ' A' ' 41' ' ' VAL . . . -122.6 140.24 53.02 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-O 121.568 0.699 . . . . 0.0 109.51 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.746 ' HB ' ' HD2' ' A' ' 14' ' ' PRO . 0.2 OUTLIER -125.09 -149.04 0.0 OUTLIER Pre-proline 0 C--N 1.291 -1.967 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.901 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.758 ' HA ' ' HB2' ' A' ' 17' ' ' GLN . 42.0 Cg_endo -69.17 -10.9 30.28 Favored 'Trans proline' 0 C--N 1.321 -0.91 0 CA-C-N 120.031 1.047 . . . . 0.0 110.541 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.707 ' O ' ' CG ' ' A' ' 18' ' ' GLU . 0.1 OUTLIER -68.85 -23.35 64.23 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 121.114 -0.991 . . . . 0.0 110.02 178.208 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.467 ' CG2' ' CB ' ' A' ' 40' ' ' ALA . 1.5 mp -94.07 -17.35 7.25 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.393 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.758 ' HB2' ' HA ' ' A' ' 14' ' ' PRO . 0.8 OUTLIER -71.58 -21.28 61.89 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.104 179.013 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.707 ' CG ' ' O ' ' A' ' 15' ' ' GLU . 1.0 OUTLIER -80.22 -50.83 9.7 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 106.017 -1.845 . . . . 0.0 106.017 177.966 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.671 ' H ' ' HG3' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -58.14 -30.17 38.71 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 175.427 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' A' ' 17' ' ' GLN . 2.0 t -80.59 -34.18 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.335 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.479 ' N ' ' O ' ' A' ' 17' ' ' GLN . 5.5 m-20 -78.21 -25.04 46.87 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.659 0.743 . . . . 0.0 109.526 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -76.03 -30.02 58.31 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.747 -0.595 . . . . 0.0 111.221 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.438 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 25.0 m -103.45 -22.41 4.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 O-C-N 121.075 -1.016 . . . . 0.0 111.071 -178.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.566 ' HA ' ' HB3' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -57.11 -22.0 36.45 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.122 -1.031 . . . . 0.0 110.53 -179.623 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.62 -48.55 54.51 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 118.96 -1.096 . . . . 0.0 108.083 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.493 ' O ' ' CG ' ' A' ' 30' ' ' LYS . 33.5 mt-30 -77.53 -33.2 54.3 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.566 ' HB3' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -69.67 -34.09 73.49 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.192 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.531 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 0.3 OUTLIER -58.25 -55.29 36.86 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.478 -0.764 . . . . 0.0 110.334 178.527 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -91.28 13.1 18.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.384 -0.822 . . . . 0.0 111.578 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.493 ' CG ' ' O ' ' A' ' 26' ' ' GLN . 2.1 mmtt -89.2 -63.48 1.28 Allowed 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 177.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.528 ' O ' ' ND2' ' A' ' 32' ' ' ASN . 99.8 m -113.13 31.86 6.14 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.528 ' ND2' ' O ' ' A' ' 31' ' ' THR . 0.2 OUTLIER 53.55 34.46 18.54 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 122.311 1.053 . . . . 0.0 109.391 179.187 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -78.21 -143.81 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.539 -0.726 . . . . 0.0 110.571 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.531 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 0.5 OUTLIER -170.65 -47.36 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.342 -0.849 . . . . 0.0 110.374 -178.44 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.518 ' N ' ' CG2' ' A' ' 34' ' ' THR . 2.7 m-30 45.04 -171.26 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.588 -0.695 . . . . 0.0 110.829 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 81.28 -46.42 3.4 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.0 tptt -90.15 21.37 3.78 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.376 -1.073 . . . . 0.0 109.91 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.449 HD23 ' CG ' ' A' ' 35' ' ' TYR . 0.4 OUTLIER -117.88 154.32 32.06 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.587 -0.696 . . . . 0.0 109.34 179.153 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -104.9 118.97 37.87 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.184 -0.947 . . . . 0.0 110.532 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.467 ' CB ' ' CG2' ' A' ' 16' ' ' ILE . . . -79.17 109.89 13.92 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.477 -0.764 . . . . 0.0 109.133 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.541 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 37.6 t -84.34 -26.39 7.13 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 C-N-CA 119.839 -0.745 . . . . 0.0 110.196 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.561 ' CG ' ' N ' ' A' ' 43' ' ' TYR . 1.5 tt0 -159.06 175.61 13.3 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.057 -1.027 . . . . 0.0 111.414 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.808 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 46.1 p90 -160.58 165.06 31.41 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.412 1.101 . . . . 0.0 113.228 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.486 ' HG3' ' HA ' ' A' ' 9' ' ' ALA . 0.2 OUTLIER -135.28 -169.68 2.43 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.301 178.783 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.474 ' CG2' ' CE2' ' A' ' 53' ' ' TYR . 1.2 p -159.87 156.39 27.28 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.23 -0.919 . . . . 0.0 110.628 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.456 ' CG ' ' N ' ' A' ' 47' ' ' VAL . 9.6 tt0 -139.48 170.5 15.8 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.302 -0.874 . . . . 0.0 110.004 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.456 ' N ' ' CG ' ' A' ' 46' ' ' GLN . 50.8 t -126.33 114.63 39.17 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.712 0 CA-C-O 121.58 0.705 . . . . 0.0 110.493 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.7 t -141.75 -123.35 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.7 54.83 1.27 Allowed 'General case' 0 C--N 1.294 -1.826 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.55 ' HA3' ' O ' ' A' ' 71' ' ' LYS . . . 129.23 -134.59 8.03 Favored Glycine 0 N--CA 1.482 1.756 0 N-CA-C 107.814 -2.114 . . . . 0.0 107.814 -177.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.665 HG22 ' HB3' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -142.27 127.34 18.47 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.475 -1.015 . . . . 0.0 111.734 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.555 ' HA ' ' HA ' ' A' ' 70' ' ' PHE . 0.0 OUTLIER -112.02 176.82 4.86 Favored 'General case' 0 C--N 1.294 -1.846 0 O-C-N 120.823 -1.173 . . . . 0.0 110.182 178.267 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.475 ' CB ' ' CD1' ' A' ' 19' ' ' ILE . 6.1 m-85 -144.59 125.68 14.55 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.824 -0.547 . . . . 0.0 109.541 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.491 ' CE1' ' HG3' ' A' ' 68' ' ' LYS . 7.2 m-30 -100.23 141.04 33.61 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.539 HD12 ' HB2' ' A' ' 43' ' ' TYR . 6.4 mm -131.31 131.75 63.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 C-N-CA 118.568 -1.253 . . . . 0.0 113.186 -177.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.1 tttt -92.13 79.88 5.11 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.437 HG22 ' N ' ' A' ' 58' ' ' ARG . 7.1 p -106.54 149.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.533 -0.729 . . . . 0.0 110.395 -178.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.464 ' HA ' ' HA ' ' A' ' 64' ' ' TYR . 14.1 ttp180 -105.57 163.5 12.61 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.57 -0.707 . . . . 0.0 110.455 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.431 ' CB ' HD13 ' A' ' 65' ' ' LEU . . . -134.29 33.3 3.34 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.498 -0.752 . . . . 0.0 111.152 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 176.51 -115.72 0.53 Allowed Glycine 0 N--CA 1.482 1.749 0 N-CA-C 108.871 -1.692 . . . . 0.0 108.871 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.69 21.52 0.61 Allowed 'General case' 0 C--N 1.282 -2.342 0 CA-C-O 121.724 0.773 . . . . 0.0 109.786 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -172.43 33.27 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.509 0 CA-C-O 121.419 0.628 . . . . 0.0 109.34 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -158.28 147.96 19.7 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.631 -0.668 . . . . 0.0 110.069 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 58' ' ' ARG . 2.5 m-85 -133.74 157.3 46.21 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.983 0.897 . . . . 0.0 110.343 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.431 HD13 ' CB ' ' A' ' 59' ' ' ALA . 0.3 OUTLIER -134.12 127.13 31.47 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.553 -178.957 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.521 ' HB3' ' CE2' ' A' ' 98' ' ' PHE . 10.2 m-70 -104.17 112.73 25.86 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.62 -0.675 . . . . 0.0 109.566 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.515 ' CD2' ' HB ' ' A' ' 55' ' ' ILE . 0.2 OUTLIER -98.86 162.45 13.09 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.88 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.523 ' O ' ' HA ' ' A' ' 82' ' ' LEU . 0.0 OUTLIER -128.01 85.7 2.38 Favored 'General case' 0 C--N 1.3 -1.546 0 C-N-CA 120.337 -0.545 . . . . 0.0 109.824 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.538 ' O ' ' HA ' ' A' ' 52' ' ' ASN . 23.3 t -79.59 127.15 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.555 ' HA ' ' HA ' ' A' ' 52' ' ' ASN 0.253 0.4 OUTLIER -123.32 134.5 54.04 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.199 -0.938 . . . . 0.0 112.144 -177.362 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.665 ' HB3' HG22 ' A' ' 51' ' ' THR . 0.7 OUTLIER -118.47 142.78 47.23 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.093 178.318 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.64 ' O ' ' CB ' ' A' ' 73' ' ' LEU . 29.0 t -104.74 -119.52 0.22 Allowed 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 119.02 -1.072 . . . . 0.0 111.847 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.68 ' N ' ' HD2' ' A' ' 74' ' ' PRO . 0.3 OUTLIER 145.88 -49.98 0.0 OUTLIER Pre-proline 0 N--CA 1.5 2.055 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 -177.483 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.68 ' HD2' ' N ' ' A' ' 73' ' ' LEU . 51.0 Cg_endo -72.71 -11.26 25.87 Favored 'Trans proline' 0 N--CA 1.486 1.063 0 O-C-N 124.033 1.544 . . . . 0.0 109.643 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.473 ' O ' ' CG ' ' A' ' 78' ' ' GLU . . . -150.94 49.74 0.54 Allowed Glycine 0 N--CA 1.482 1.765 0 N-CA-C 105.057 -3.217 . . . . 0.0 105.057 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.495 ' O ' ' C ' ' A' ' 77' ' ' ASN . 0.0 OUTLIER -28.51 -43.53 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 121.95 0.881 . . . . 0.0 112.024 -177.592 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.495 ' C ' ' O ' ' A' ' 76' ' ' GLN . 1.7 p-10 -29.23 -45.61 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.004 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.497 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.568 ' O ' ' O ' ' A' ' 79' ' ' ASP . 0.9 OUTLIER -69.62 -73.99 0.14 Allowed 'General case' 0 C--N 1.295 -1.775 0 C-N-CA 119.797 -0.761 . . . . 0.0 109.648 178.495 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.568 ' O ' ' O ' ' A' ' 78' ' ' GLU . 0.4 OUTLIER 54.73 134.5 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.191 0 O-C-N 121.65 -0.656 . . . . 0.0 110.422 179.898 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.483 ' C ' ' O ' ' A' ' 79' ' ' ASP . 0.4 OUTLIER 30.18 48.46 0.05 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.6 -0.687 . . . . 0.0 112.061 -179.511 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.535 ' N ' ' O ' ' A' ' 70' ' ' PHE . 13.2 t -89.96 83.4 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.351 -0.843 . . . . 0.0 109.596 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.523 ' HA ' ' O ' ' A' ' 68' ' ' LYS . 0.7 OUTLIER -60.76 91.3 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.408 -0.808 . . . . 0.0 109.406 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 57.2 m -93.33 3.05 56.26 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.563 -0.711 . . . . 0.0 110.98 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.493 ' O ' ' HB3' ' A' ' 85' ' ' TYR . . . -138.08 154.75 22.97 Favored Glycine 0 N--CA 1.489 2.189 0 C-N-CA 118.688 -1.72 . . . . 0.0 109.35 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.508 ' HA ' ' O ' ' A' ' 66' ' ' HIS . 10.9 p90 169.55 177.8 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.538 -0.978 . . . . 0.0 111.028 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.437 ' HG3' ' CE1' ' A' ' 98' ' ' PHE . 0.0 OUTLIER -160.41 149.38 17.1 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.676 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.445 ' O ' ' CG ' ' A' ' 89' ' ' LYS . 27.6 m -141.99 174.2 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.024 -1.048 . . . . 0.0 111.737 -178.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 39.98 69.04 0.33 Allowed 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.445 ' CG ' ' O ' ' A' ' 87' ' ' VAL . 2.5 mtpp -144.02 156.06 44.24 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.021 -1.049 . . . . 0.0 110.312 177.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -144.95 27.93 1.28 Allowed 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -147.05 -34.38 0.26 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.955 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -122.94 27.46 7.67 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.143 -0.973 . . . . 0.0 110.931 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.15 51.09 0.76 Allowed 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.538 -0.726 . . . . 0.0 109.486 178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 94' ' ' GLU . 0.1 OUTLIER -105.38 120.43 41.57 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.288 -0.883 . . . . 0.0 111.132 -179.696 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.508 HD12 ' N ' ' A' ' 96' ' ' THR . 0.1 OUTLIER 51.11 -116.89 1.03 Allowed 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.618 -0.676 . . . . 0.0 111.442 177.346 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.593 ' C ' ' H ' ' A' ' 98' ' ' PHE . 86.1 m -118.46 -19.69 8.73 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.79 -1.193 . . . . 0.0 110.963 -178.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -65.65 14.87 0.24 Allowed Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.724 -1.351 . . . . 0.0 109.724 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.593 ' H ' ' C ' ' A' ' 96' ' ' THR . 29.4 p90 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 120.998 -1.295 . . . . 0.0 110.397 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 mmm . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.223 0.535 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 2.0 tp -130.28 135.77 27.95 Favored Pre-proline 0 N--CA 1.493 1.677 0 O-C-N 121.329 -0.857 . . . . 0.0 110.169 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.43 -166.0 0.28 Allowed 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 123.62 1.326 . . . . 0.0 110.351 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 111.09 -63.03 0.28 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.549 ' O ' ' C ' ' A' ' 6' ' ' LEU . . . 85.88 39.54 8.04 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 110.194 -1.163 . . . . 0.0 110.194 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.668 HD22 ' HB ' ' A' ' 96' ' ' THR . 0.0 OUTLIER -43.43 120.36 1.9 Allowed 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 178.333 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.3 t -64.06 -69.82 0.26 Allowed 'General case' 0 C--N 1.274 -2.706 0 C-N-CA 119.016 -1.074 . . . . 0.0 110.681 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.616 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 4.8 tp10 -134.93 -139.87 0.17 Allowed 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.264 -0.898 . . . . 0.0 111.207 -179.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.808 ' HA ' ' O ' ' A' ' 43' ' ' TYR . . . 166.28 66.86 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.551 ' O ' ' HA ' ' A' ' 42' ' ' GLN . 1.7 ptmt -97.21 -179.13 0.83 Allowed Pre-proline 0 C--N 1.301 -1.501 0 O-C-N 121.68 -0.637 . . . . 0.0 109.856 -179.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.622 ' HA ' ' O ' ' A' ' 41' ' ' VAL . 33.1 Cg_endo -58.74 149.44 77.2 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.764 1.402 . . . . 0.0 110.808 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 40' ' ' ALA . . . -122.6 140.24 53.02 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-O 121.568 0.699 . . . . 0.0 109.51 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.779 ' HB ' ' HD2' ' A' ' 14' ' ' PRO . 0.2 OUTLIER -125.09 -149.04 0.0 OUTLIER Pre-proline 0 C--N 1.291 -1.967 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.901 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.86 ' HA ' ' HB2' ' A' ' 17' ' ' GLN . 42.0 Cg_endo -69.17 -10.9 30.28 Favored 'Trans proline' 0 C--N 1.321 -0.91 0 CA-C-N 120.031 1.047 . . . . 0.0 110.541 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.707 ' O ' ' CG ' ' A' ' 18' ' ' GLU . 0.1 OUTLIER -68.85 -23.35 64.23 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 121.114 -0.991 . . . . 0.0 110.02 178.208 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.762 HG21 ' HB1' ' A' ' 40' ' ' ALA . 1.5 mp -94.07 -17.35 7.25 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.393 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.86 ' HB2' ' HA ' ' A' ' 14' ' ' PRO . 6.3 tp60 -71.58 -21.28 61.89 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.104 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.707 ' CG ' ' O ' ' A' ' 15' ' ' GLU . 1.0 OUTLIER -80.22 -50.83 9.7 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 106.017 -1.845 . . . . 0.0 106.017 177.966 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.899 HG23 HG21 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -58.14 -30.17 38.71 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 175.427 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.711 ' HB ' ' HA ' ' A' ' 17' ' ' GLN . 2.0 t -80.59 -34.18 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.335 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.479 ' N ' ' O ' ' A' ' 17' ' ' GLN . 5.5 m-20 -78.21 -25.04 46.87 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.659 0.743 . . . . 0.0 109.526 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.475 ' HB3' HD13 ' A' ' 80' ' ' LEU . 3.6 mtmt -76.03 -30.02 58.31 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.747 -0.595 . . . . 0.0 111.221 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.772 HG11 HG22 ' A' ' 69' ' ' VAL . 25.0 m -103.45 -22.41 4.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 O-C-N 121.075 -1.016 . . . . 0.0 111.071 -178.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' HB3' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -57.11 -22.0 36.45 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.122 -1.031 . . . . 0.0 110.53 -179.623 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.62 -48.55 54.51 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 118.96 -1.096 . . . . 0.0 108.083 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.493 ' O ' ' CG ' ' A' ' 30' ' ' LYS . 33.5 mt-30 -77.53 -33.2 54.3 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.591 ' HB3' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -69.67 -34.09 73.49 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.192 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.562 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 0.3 OUTLIER -58.25 -55.29 36.86 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.478 -0.764 . . . . 0.0 110.334 178.527 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -91.28 13.1 18.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.384 -0.822 . . . . 0.0 111.578 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.493 ' CG ' ' O ' ' A' ' 26' ' ' GLN . 2.1 mmtt -89.2 -63.48 1.28 Allowed 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 177.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.611 ' O ' HG22 ' A' ' 31' ' ' THR . 99.8 m -113.13 31.86 6.14 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.528 ' ND2' ' O ' ' A' ' 31' ' ' THR . 0.2 OUTLIER 53.55 34.46 18.54 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 122.311 1.053 . . . . 0.0 109.391 179.187 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.684 ' CD ' HG21 ' A' ' 87' ' ' VAL . 5.3 tp10 -78.21 -143.81 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.539 -0.726 . . . . 0.0 110.571 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.562 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 0.5 OUTLIER -170.65 -47.36 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.342 -0.849 . . . . 0.0 110.374 -178.44 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.716 ' CE2' HD22 ' A' ' 67' ' ' LEU . 2.7 m-30 45.04 -171.26 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.588 -0.695 . . . . 0.0 110.829 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 81.28 -46.42 3.4 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.0 tptt -90.15 21.37 3.78 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.376 -1.073 . . . . 0.0 109.91 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.923 HD13 HG21 ' A' ' 57' ' ' VAL . 0.4 OUTLIER -117.88 154.32 32.06 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.587 -0.696 . . . . 0.0 109.34 179.153 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.729 ' C ' HG23 ' A' ' 57' ' ' VAL . 1.1 pt-20 -104.9 118.97 37.87 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.184 -0.947 . . . . 0.0 110.532 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.762 ' HB1' HG21 ' A' ' 16' ' ' ILE . . . -79.17 109.89 13.92 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.477 -0.764 . . . . 0.0 109.133 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.622 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 37.6 t -84.34 -26.39 7.13 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 C-N-CA 119.839 -0.745 . . . . 0.0 110.196 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.696 ' NE2' ' HB1' ' A' ' 9' ' ' ALA . 1.5 tt0 -159.06 175.61 13.3 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.057 -1.027 . . . . 0.0 111.414 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.808 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 46.1 p90 -160.58 165.06 31.41 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.412 1.101 . . . . 0.0 113.228 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.675 ' O ' HG23 ' A' ' 45' ' ' THR . 0.2 OUTLIER -135.28 -169.68 2.43 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.301 178.783 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.675 HG23 ' O ' ' A' ' 44' ' ' LYS . 1.2 p -159.87 156.39 27.28 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.23 -0.919 . . . . 0.0 110.628 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.456 ' CG ' ' N ' ' A' ' 47' ' ' VAL . 9.6 tt0 -139.48 170.5 15.8 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.302 -0.874 . . . . 0.0 110.004 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.456 ' N ' ' CG ' ' A' ' 46' ' ' GLN . 50.8 t -126.33 114.63 39.17 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.712 0 CA-C-O 121.58 0.705 . . . . 0.0 110.493 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.7 t -141.75 -123.35 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.7 54.83 1.27 Allowed 'General case' 0 C--N 1.294 -1.826 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.546 ' HA3' ' O ' ' A' ' 71' ' ' LYS . . . 129.23 -134.59 8.03 Favored Glycine 0 N--CA 1.482 1.756 0 N-CA-C 107.814 -2.114 . . . . 0.0 107.814 -177.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.718 HG22 ' HB3' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -142.27 127.34 18.47 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.475 -1.015 . . . . 0.0 111.734 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.563 ' HA ' ' HA ' ' A' ' 70' ' ' PHE . 0.0 OUTLIER -112.02 176.82 4.86 Favored 'General case' 0 C--N 1.294 -1.846 0 O-C-N 120.823 -1.173 . . . . 0.0 110.182 178.267 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.475 ' CB ' ' CD1' ' A' ' 19' ' ' ILE . 6.1 m-85 -144.59 125.68 14.55 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.824 -0.547 . . . . 0.0 109.541 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.931 ' O ' HD13 ' A' ' 55' ' ' ILE . 7.2 m-30 -100.23 141.04 33.61 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.931 HD13 ' O ' ' A' ' 54' ' ' TYR . 6.4 mm -131.31 131.75 63.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 C-N-CA 118.568 -1.253 . . . . 0.0 113.186 -177.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.1 tttt -92.13 79.88 5.11 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.923 HG21 HD13 ' A' ' 38' ' ' LEU . 7.1 p -106.54 149.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.533 -0.729 . . . . 0.0 110.395 -178.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.469 ' HA ' ' HA ' ' A' ' 64' ' ' TYR . 14.1 ttp180 -105.57 163.5 12.61 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.57 -0.707 . . . . 0.0 110.455 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.411 ' HB2' HD11 ' A' ' 65' ' ' LEU . . . -134.29 33.3 3.34 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.498 -0.752 . . . . 0.0 111.152 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 176.51 -115.72 0.53 Allowed Glycine 0 N--CA 1.482 1.749 0 N-CA-C 108.871 -1.692 . . . . 0.0 108.871 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.69 21.52 0.61 Allowed 'General case' 0 C--N 1.282 -2.342 0 CA-C-O 121.724 0.773 . . . . 0.0 109.786 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -172.43 33.27 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.509 0 CA-C-O 121.419 0.628 . . . . 0.0 109.34 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -158.28 147.96 19.7 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.631 -0.668 . . . . 0.0 110.069 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.469 ' HA ' ' HA ' ' A' ' 58' ' ' ARG . 2.5 m-85 -133.74 157.3 46.21 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.983 0.897 . . . . 0.0 110.343 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.864 HD12 ' O ' ' A' ' 57' ' ' VAL . 0.3 OUTLIER -134.12 127.13 31.47 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.553 -178.957 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.547 ' HB3' ' CE2' ' A' ' 98' ' ' PHE . 10.2 m-70 -104.17 112.73 25.86 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.62 -0.675 . . . . 0.0 109.566 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.776 HD11 HG13 ' A' ' 55' ' ' ILE . 0.2 OUTLIER -98.86 162.45 13.09 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.88 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.565 ' O ' ' HA ' ' A' ' 82' ' ' LEU . 0.0 OUTLIER -128.01 85.7 2.38 Favored 'General case' 0 C--N 1.3 -1.546 0 C-N-CA 120.337 -0.545 . . . . 0.0 109.824 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.899 HG21 HG23 ' A' ' 19' ' ' ILE . 23.3 t -79.59 127.15 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.563 ' HA ' ' HA ' ' A' ' 52' ' ' ASN 0.253 0.4 OUTLIER -123.32 134.5 54.04 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.199 -0.938 . . . . 0.0 112.144 -177.362 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.718 ' HB3' HG22 ' A' ' 51' ' ' THR . 0.7 OUTLIER -118.47 142.78 47.23 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.093 178.318 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.64 ' O ' ' CB ' ' A' ' 73' ' ' LEU . 29.0 t -104.74 -119.52 0.22 Allowed 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 119.02 -1.072 . . . . 0.0 111.847 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.706 ' N ' ' HD2' ' A' ' 74' ' ' PRO . 0.3 OUTLIER 145.88 -49.98 0.0 OUTLIER Pre-proline 0 N--CA 1.5 2.055 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 -177.483 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.706 ' HD2' ' N ' ' A' ' 73' ' ' LEU . 51.0 Cg_endo -72.71 -11.26 25.87 Favored 'Trans proline' 0 N--CA 1.486 1.063 0 O-C-N 124.033 1.544 . . . . 0.0 109.643 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.473 ' O ' ' CG ' ' A' ' 78' ' ' GLU . . . -150.94 49.74 0.54 Allowed Glycine 0 N--CA 1.482 1.765 0 N-CA-C 105.057 -3.217 . . . . 0.0 105.057 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.495 ' O ' ' C ' ' A' ' 77' ' ' ASN . 0.0 OUTLIER -28.51 -43.53 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 121.95 0.881 . . . . 0.0 112.024 -177.592 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.495 ' C ' ' O ' ' A' ' 76' ' ' GLN . 1.7 p-10 -29.23 -45.61 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.004 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.497 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.568 ' O ' ' O ' ' A' ' 79' ' ' ASP . 0.9 OUTLIER -69.62 -73.99 0.14 Allowed 'General case' 0 C--N 1.295 -1.775 0 C-N-CA 119.797 -0.761 . . . . 0.0 109.648 178.495 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.568 ' O ' ' O ' ' A' ' 78' ' ' GLU . 0.4 OUTLIER 54.73 134.5 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.191 0 O-C-N 121.65 -0.656 . . . . 0.0 110.422 179.898 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.537 ' O ' HD12 ' A' ' 80' ' ' LEU . 0.4 OUTLIER 30.18 48.46 0.05 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.6 -0.687 . . . . 0.0 112.061 -179.511 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.644 ' O ' HG12 ' A' ' 81' ' ' VAL . 13.2 t -89.96 83.4 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.351 -0.843 . . . . 0.0 109.596 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.625 HD11 ' HB2' ' A' ' 67' ' ' LEU . 0.7 OUTLIER -60.76 91.3 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.408 -0.808 . . . . 0.0 109.406 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.548 ' OG1' HG12 ' A' ' 81' ' ' VAL . 57.2 m -93.33 3.05 56.26 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.563 -0.711 . . . . 0.0 110.98 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.496 ' O ' ' HB3' ' A' ' 85' ' ' TYR . . . -138.08 154.75 22.97 Favored Glycine 0 N--CA 1.489 2.189 0 C-N-CA 118.688 -1.72 . . . . 0.0 109.35 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.538 ' HA ' ' O ' ' A' ' 66' ' ' HIS . 10.9 p90 169.55 177.8 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.538 -0.978 . . . . 0.0 111.028 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.436 ' HG3' ' CE1' ' A' ' 98' ' ' PHE . 1.8 mt-30 -160.41 149.38 17.1 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.904 HG23 ' OD1' ' A' ' 88' ' ' ASP . 27.6 m -141.99 174.2 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.024 -1.048 . . . . 0.0 111.737 -178.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.904 ' OD1' HG23 ' A' ' 87' ' ' VAL . 5.1 p-10 39.98 69.04 0.33 Allowed 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.445 ' CG ' ' O ' ' A' ' 87' ' ' VAL . 2.5 mtpp -144.02 156.06 44.24 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.021 -1.049 . . . . 0.0 110.312 177.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -144.95 27.93 1.28 Allowed 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -147.05 -34.38 0.26 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.955 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' A' ' 98' ' ' PHE . 11.0 t0 -122.94 27.46 7.67 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.143 -0.973 . . . . 0.0 110.931 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.403 ' HB2' ' HB2' ' A' ' 89' ' ' LYS . 0.5 OUTLIER -106.15 51.09 0.76 Allowed 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.538 -0.726 . . . . 0.0 109.486 178.938 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.38 120.43 41.57 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.288 -0.883 . . . . 0.0 111.132 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.557 HD12 ' N ' ' A' ' 96' ' ' THR . 0.1 OUTLIER 51.11 -116.89 1.03 Allowed 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.618 -0.676 . . . . 0.0 111.442 177.346 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.668 ' HB ' HD22 ' A' ' 6' ' ' LEU . 86.1 m -118.46 -19.69 8.73 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.79 -1.193 . . . . 0.0 110.963 -178.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -65.65 14.87 0.24 Allowed Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.724 -1.351 . . . . 0.0 109.724 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.554 ' H ' ' C ' ' A' ' 96' ' ' THR . 29.4 p90 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 120.998 -1.295 . . . . 0.0 110.397 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 mmm . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.223 0.535 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 2.0 tp -130.28 135.77 27.95 Favored Pre-proline 0 N--CA 1.493 1.677 0 O-C-N 121.329 -0.857 . . . . 0.0 110.169 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.43 -166.0 0.28 Allowed 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 123.62 1.326 . . . . 0.0 110.351 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 111.09 -63.03 0.28 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.549 ' O ' ' C ' ' A' ' 6' ' ' LEU . . . 85.88 39.54 8.04 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 110.194 -1.163 . . . . 0.0 110.194 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.668 HD22 ' HB ' ' A' ' 96' ' ' THR . 0.0 OUTLIER -43.43 120.36 1.9 Allowed 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 178.333 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.3 t -64.06 -69.82 0.26 Allowed 'General case' 0 C--N 1.274 -2.706 0 C-N-CA 119.016 -1.074 . . . . 0.0 110.681 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.616 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 4.8 tp10 -134.93 -139.87 0.17 Allowed 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.264 -0.898 . . . . 0.0 111.207 -179.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.808 ' HA ' ' O ' ' A' ' 43' ' ' TYR . . . 166.28 66.86 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.551 ' O ' ' HA ' ' A' ' 42' ' ' GLN . 1.7 ptmt -97.21 -179.13 0.83 Allowed Pre-proline 0 C--N 1.301 -1.501 0 O-C-N 121.68 -0.637 . . . . 0.0 109.856 -179.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.622 ' HA ' ' O ' ' A' ' 41' ' ' VAL . 33.1 Cg_endo -58.74 149.44 77.2 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.764 1.402 . . . . 0.0 110.808 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 40' ' ' ALA . . . -122.6 140.24 53.02 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-O 121.568 0.699 . . . . 0.0 109.51 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.779 ' HB ' ' HD2' ' A' ' 14' ' ' PRO . 0.2 OUTLIER -125.09 -149.04 0.0 OUTLIER Pre-proline 0 C--N 1.291 -1.967 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.901 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.86 ' HA ' ' HB2' ' A' ' 17' ' ' GLN . 42.0 Cg_endo -69.17 -10.9 30.28 Favored 'Trans proline' 0 C--N 1.321 -0.91 0 CA-C-N 120.031 1.047 . . . . 0.0 110.541 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.707 ' O ' ' CG ' ' A' ' 18' ' ' GLU . 0.1 OUTLIER -68.85 -23.35 64.23 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 121.114 -0.991 . . . . 0.0 110.02 178.208 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.762 HG21 ' HB1' ' A' ' 40' ' ' ALA . 1.5 mp -94.07 -17.35 7.25 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.393 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.86 ' HB2' ' HA ' ' A' ' 14' ' ' PRO . 0.8 OUTLIER -71.58 -21.28 61.89 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.104 179.013 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.707 ' CG ' ' O ' ' A' ' 15' ' ' GLU . 1.0 OUTLIER -80.22 -50.83 9.7 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 106.017 -1.845 . . . . 0.0 106.017 177.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.899 HG23 HG21 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -58.14 -30.17 38.71 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 175.427 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.711 ' HB ' ' HA ' ' A' ' 17' ' ' GLN . 2.0 t -80.59 -34.18 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.335 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.479 ' N ' ' O ' ' A' ' 17' ' ' GLN . 5.5 m-20 -78.21 -25.04 46.87 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.659 0.743 . . . . 0.0 109.526 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.475 ' HB3' HD13 ' A' ' 80' ' ' LEU . 3.6 mtmt -76.03 -30.02 58.31 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.747 -0.595 . . . . 0.0 111.221 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.772 HG11 HG22 ' A' ' 69' ' ' VAL . 25.0 m -103.45 -22.41 4.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 O-C-N 121.075 -1.016 . . . . 0.0 111.071 -178.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' HB3' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -57.11 -22.0 36.45 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.122 -1.031 . . . . 0.0 110.53 -179.623 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.62 -48.55 54.51 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 118.96 -1.096 . . . . 0.0 108.083 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.493 ' O ' ' CG ' ' A' ' 30' ' ' LYS . 33.5 mt-30 -77.53 -33.2 54.3 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.591 ' HB3' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -69.67 -34.09 73.49 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.192 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.562 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 0.3 OUTLIER -58.25 -55.29 36.86 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.478 -0.764 . . . . 0.0 110.334 178.527 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -91.28 13.1 18.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.384 -0.822 . . . . 0.0 111.578 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.493 ' CG ' ' O ' ' A' ' 26' ' ' GLN . 2.1 mmtt -89.2 -63.48 1.28 Allowed 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 177.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.611 HG22 ' O ' ' A' ' 31' ' ' THR . 99.8 m -113.13 31.86 6.14 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.528 ' ND2' ' O ' ' A' ' 31' ' ' THR . 0.2 OUTLIER 53.55 34.46 18.54 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 122.311 1.053 . . . . 0.0 109.391 179.187 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.684 ' CD ' HG21 ' A' ' 87' ' ' VAL . 5.3 tp10 -78.21 -143.81 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.539 -0.726 . . . . 0.0 110.571 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.562 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 0.5 OUTLIER -170.65 -47.36 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.342 -0.849 . . . . 0.0 110.374 -178.44 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.716 ' CE2' HD22 ' A' ' 67' ' ' LEU . 2.7 m-30 45.04 -171.26 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.588 -0.695 . . . . 0.0 110.829 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 81.28 -46.42 3.4 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.0 tptt -90.15 21.37 3.78 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.376 -1.073 . . . . 0.0 109.91 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.923 HD13 HG21 ' A' ' 57' ' ' VAL . 0.4 OUTLIER -117.88 154.32 32.06 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.587 -0.696 . . . . 0.0 109.34 179.153 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.729 ' C ' HG23 ' A' ' 57' ' ' VAL . 1.1 pt-20 -104.9 118.97 37.87 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.184 -0.947 . . . . 0.0 110.532 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.762 ' HB1' HG21 ' A' ' 16' ' ' ILE . . . -79.17 109.89 13.92 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.477 -0.764 . . . . 0.0 109.133 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.622 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 37.6 t -84.34 -26.39 7.13 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 C-N-CA 119.839 -0.745 . . . . 0.0 110.196 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.696 ' NE2' ' HB1' ' A' ' 9' ' ' ALA . 1.5 tt0 -159.06 175.61 13.3 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.057 -1.027 . . . . 0.0 111.414 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.808 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 46.1 p90 -160.58 165.06 31.41 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.412 1.101 . . . . 0.0 113.228 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.675 ' O ' HG23 ' A' ' 45' ' ' THR . 0.2 OUTLIER -135.28 -169.68 2.43 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.301 178.783 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.675 HG23 ' O ' ' A' ' 44' ' ' LYS . 1.2 p -159.87 156.39 27.28 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.23 -0.919 . . . . 0.0 110.628 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.456 ' CG ' ' N ' ' A' ' 47' ' ' VAL . 9.6 tt0 -139.48 170.5 15.8 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.302 -0.874 . . . . 0.0 110.004 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.456 ' N ' ' CG ' ' A' ' 46' ' ' GLN . 50.8 t -126.33 114.63 39.17 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.712 0 CA-C-O 121.58 0.705 . . . . 0.0 110.493 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.7 t -141.75 -123.35 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.7 54.83 1.27 Allowed 'General case' 0 C--N 1.294 -1.826 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.546 ' HA3' ' O ' ' A' ' 71' ' ' LYS . . . 129.23 -134.59 8.03 Favored Glycine 0 N--CA 1.482 1.756 0 N-CA-C 107.814 -2.114 . . . . 0.0 107.814 -177.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.718 HG22 ' HB3' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -142.27 127.34 18.47 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.475 -1.015 . . . . 0.0 111.734 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.563 ' HA ' ' HA ' ' A' ' 70' ' ' PHE . 0.0 OUTLIER -112.02 176.82 4.86 Favored 'General case' 0 C--N 1.294 -1.846 0 O-C-N 120.823 -1.173 . . . . 0.0 110.182 178.267 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.475 ' CB ' ' CD1' ' A' ' 19' ' ' ILE . 6.1 m-85 -144.59 125.68 14.55 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.824 -0.547 . . . . 0.0 109.541 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.931 ' O ' HD13 ' A' ' 55' ' ' ILE . 7.2 m-30 -100.23 141.04 33.61 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.931 HD13 ' O ' ' A' ' 54' ' ' TYR . 6.4 mm -131.31 131.75 63.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 C-N-CA 118.568 -1.253 . . . . 0.0 113.186 -177.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.1 tttt -92.13 79.88 5.11 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.923 HG21 HD13 ' A' ' 38' ' ' LEU . 7.1 p -106.54 149.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.533 -0.729 . . . . 0.0 110.395 -178.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.469 ' HA ' ' HA ' ' A' ' 64' ' ' TYR . 14.1 ttp180 -105.57 163.5 12.61 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.57 -0.707 . . . . 0.0 110.455 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.411 ' HB2' HD11 ' A' ' 65' ' ' LEU . . . -134.29 33.3 3.34 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.498 -0.752 . . . . 0.0 111.152 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 176.51 -115.72 0.53 Allowed Glycine 0 N--CA 1.482 1.749 0 N-CA-C 108.871 -1.692 . . . . 0.0 108.871 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.69 21.52 0.61 Allowed 'General case' 0 C--N 1.282 -2.342 0 CA-C-O 121.724 0.773 . . . . 0.0 109.786 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -172.43 33.27 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.509 0 CA-C-O 121.419 0.628 . . . . 0.0 109.34 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -158.28 147.96 19.7 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.631 -0.668 . . . . 0.0 110.069 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.469 ' HA ' ' HA ' ' A' ' 58' ' ' ARG . 2.5 m-85 -133.74 157.3 46.21 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.983 0.897 . . . . 0.0 110.343 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.864 HD12 ' O ' ' A' ' 57' ' ' VAL . 0.3 OUTLIER -134.12 127.13 31.47 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.553 -178.957 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.547 ' HB3' ' CE2' ' A' ' 98' ' ' PHE . 10.2 m-70 -104.17 112.73 25.86 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.62 -0.675 . . . . 0.0 109.566 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.776 HD11 HG13 ' A' ' 55' ' ' ILE . 0.2 OUTLIER -98.86 162.45 13.09 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.88 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.565 ' O ' ' HA ' ' A' ' 82' ' ' LEU . 0.0 OUTLIER -128.01 85.7 2.38 Favored 'General case' 0 C--N 1.3 -1.546 0 C-N-CA 120.337 -0.545 . . . . 0.0 109.824 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.899 HG21 HG23 ' A' ' 19' ' ' ILE . 23.3 t -79.59 127.15 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.563 ' HA ' ' HA ' ' A' ' 52' ' ' ASN 0.253 0.4 OUTLIER -123.32 134.5 54.04 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.199 -0.938 . . . . 0.0 112.144 -177.362 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.718 ' HB3' HG22 ' A' ' 51' ' ' THR . 0.7 OUTLIER -118.47 142.78 47.23 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.093 178.318 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.64 ' O ' ' CB ' ' A' ' 73' ' ' LEU . 29.0 t -104.74 -119.52 0.22 Allowed 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 119.02 -1.072 . . . . 0.0 111.847 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.706 ' N ' ' HD2' ' A' ' 74' ' ' PRO . 0.3 OUTLIER 145.88 -49.98 0.0 OUTLIER Pre-proline 0 N--CA 1.5 2.055 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 -177.483 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.706 ' HD2' ' N ' ' A' ' 73' ' ' LEU . 51.0 Cg_endo -72.71 -11.26 25.87 Favored 'Trans proline' 0 N--CA 1.486 1.063 0 O-C-N 124.033 1.544 . . . . 0.0 109.643 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.473 ' O ' ' CG ' ' A' ' 78' ' ' GLU . . . -150.94 49.74 0.54 Allowed Glycine 0 N--CA 1.482 1.765 0 N-CA-C 105.057 -3.217 . . . . 0.0 105.057 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.495 ' O ' ' C ' ' A' ' 77' ' ' ASN . 0.0 OUTLIER -28.51 -43.53 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 121.95 0.881 . . . . 0.0 112.024 -177.592 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.495 ' C ' ' O ' ' A' ' 76' ' ' GLN . 1.7 p-10 -29.23 -45.61 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.004 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.497 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.568 ' O ' ' O ' ' A' ' 79' ' ' ASP . 0.9 OUTLIER -69.62 -73.99 0.14 Allowed 'General case' 0 C--N 1.295 -1.775 0 C-N-CA 119.797 -0.761 . . . . 0.0 109.648 178.495 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.568 ' O ' ' O ' ' A' ' 78' ' ' GLU . 0.4 OUTLIER 54.73 134.5 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.191 0 O-C-N 121.65 -0.656 . . . . 0.0 110.422 179.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.537 ' O ' HD12 ' A' ' 80' ' ' LEU . 0.4 OUTLIER 30.18 48.46 0.05 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.6 -0.687 . . . . 0.0 112.061 -179.511 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.644 ' O ' HG12 ' A' ' 81' ' ' VAL . 13.2 t -89.96 83.4 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.351 -0.843 . . . . 0.0 109.596 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.625 HD11 ' HB2' ' A' ' 67' ' ' LEU . 0.7 OUTLIER -60.76 91.3 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.408 -0.808 . . . . 0.0 109.406 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.548 ' OG1' HG12 ' A' ' 81' ' ' VAL . 57.2 m -93.33 3.05 56.26 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.563 -0.711 . . . . 0.0 110.98 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.496 ' O ' ' HB3' ' A' ' 85' ' ' TYR . . . -138.08 154.75 22.97 Favored Glycine 0 N--CA 1.489 2.189 0 C-N-CA 118.688 -1.72 . . . . 0.0 109.35 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.538 ' HA ' ' O ' ' A' ' 66' ' ' HIS . 10.9 p90 169.55 177.8 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.538 -0.978 . . . . 0.0 111.028 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.436 ' HG3' ' CE1' ' A' ' 98' ' ' PHE . 0.0 OUTLIER -160.41 149.38 17.1 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.676 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.904 HG23 ' OD1' ' A' ' 88' ' ' ASP . 27.6 m -141.99 174.2 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.024 -1.048 . . . . 0.0 111.737 -178.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.904 ' OD1' HG23 ' A' ' 87' ' ' VAL . 5.1 p-10 39.98 69.04 0.33 Allowed 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.445 ' CG ' ' O ' ' A' ' 87' ' ' VAL . 2.5 mtpp -144.02 156.06 44.24 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.021 -1.049 . . . . 0.0 110.312 177.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -144.95 27.93 1.28 Allowed 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -147.05 -34.38 0.26 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.955 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' A' ' 98' ' ' PHE . 11.0 t0 -122.94 27.46 7.67 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.143 -0.973 . . . . 0.0 110.931 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.403 ' HB2' ' HB2' ' A' ' 89' ' ' LYS . 0.5 OUTLIER -106.15 51.09 0.76 Allowed 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.538 -0.726 . . . . 0.0 109.486 178.938 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.38 120.43 41.57 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.288 -0.883 . . . . 0.0 111.132 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.557 HD12 ' N ' ' A' ' 96' ' ' THR . 0.1 OUTLIER 51.11 -116.89 1.03 Allowed 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.618 -0.676 . . . . 0.0 111.442 177.346 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.668 ' HB ' HD22 ' A' ' 6' ' ' LEU . 86.1 m -118.46 -19.69 8.73 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.79 -1.193 . . . . 0.0 110.963 -178.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -65.65 14.87 0.24 Allowed Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.724 -1.351 . . . . 0.0 109.724 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.554 ' H ' ' C ' ' A' ' 96' ' ' THR . 29.4 p90 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 120.998 -1.295 . . . . 0.0 110.397 -179.89 . . . . . . . . 1 1 . 1 stop_ save_