data_1j57_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 1j57 _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 . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.799 0.333 . . . . 18.09 111.189 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . 0.487 ' HD1' ' H ' ' A' ' 4' ' ' HIS . 24.3 p80 -74.83 155.77 37.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.208 -0.451 . . . . 18.68 110.919 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -95.21 20.52 9.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.1 -0.5 . . . . 15.24 110.886 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.487 ' H ' ' HD1' ' A' ' 2' ' ' HIS . 0.1 OUTLIER 56.22 -157.72 0.25 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.171 -0.468 . . . . 17.59 110.915 179.896 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.11 57.37 4.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.307 -0.406 . . . . 14.49 110.724 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.44 15.5 0.7 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.995 -0.548 . . . . 10.6 110.685 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -78.69 136.02 37.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.073 -0.512 . . . . 9.9900000000000002 111.083 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 136.78 -47.73 0.95 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.614 -0.803 . . . . 5.7300000000000004 112.877 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.2 m -72.77 81.84 1.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.867 0.365 . . . . 6.1500000000000004 110.981 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.559 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -127.85 121.65 30.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.075 -0.512 . . . . 3.1600000000000001 110.855 179.511 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.763 ' HB3' ' O ' ' A' ' 128' ' ' THR . 0.2 OUTLIER 166.76 37.29 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.716 0.769 . . . . 2.1000000000000001 109.392 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 1.064 ' HA ' ' HB3' ' A' ' 129' ' ' PRO . 0.0 OUTLIER -68.33 -172.22 0.31 Allowed 'General case' 0 CA--C 1.5 -0.975 0 CA-C-N 114.926 -1.034 . . . . 1.1299999999999999 110.466 179.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.889 ' HA ' ' HB ' ' A' ' 16' ' ' ILE . 1.5 t-20 -59.14 -16.22 18.75 Favored 'General case' 0 C--O 1.213 -0.819 0 N-CA-C 106.495 -1.668 . . . . 0.88 106.495 176.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.515 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 30.5 t -53.96 -59.09 5.1 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.383 -0.969 . . . . 1.21 108.383 177.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.417 ' HB2' ' HD3' ' A' ' 11' ' ' LYS . 16.1 mt-10 -81.19 -38.85 26.39 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 114.785 -1.098 . . . . 2.02 109.114 178.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.926 HD11 ' HB3' ' A' ' 107' ' ' LEU . 0.9 OUTLIER -59.17 -25.76 31.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 115.312 -0.858 . . . . 1.25 111.433 -179.685 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.833 ' HB3' ' ND2' ' A' ' 13' ' ' ASN . 1.1 pp -83.86 -31.27 25.85 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.503 -0.925 . . . . 1.1399999999999999 108.503 176.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.806 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -65.38 -60.42 2.98 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 114.888 -1.051 . . . . 2.0699999999999998 112.823 -179.302 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.877 ' NE2' ' HA ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -69.71 -45.49 68.09 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 116.249 1.944 . . . . 1.8400000000000001 116.249 -177.188 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.769 HD11 ' HA ' ' A' ' 105' ' ' SER . 9.7 mt -85.03 -22.64 28.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.413 1.264 . . . . 1.1699999999999999 114.413 -176.245 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.74 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 3.1 mmpt? -89.99 -27.36 19.82 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 119.915 -0.714 . . . . 1.5700000000000001 110.352 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.806 ' HB3' ' O ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -85.55 -49.95 7.63 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.372 -0.831 . . . . 2.77 111.936 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.417 ' HB2' ' CE ' ' A' ' 104' ' ' LYS . . . -97.97 -52.68 3.63 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 112.608 0.595 . . . . 1.1399999999999999 112.608 -177.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.558 ' HB2' ' HA ' ' A' ' 20' ' ' LEU . 0.9 OUTLIER -57.86 -14.9 6.88 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.775 -0.37 . . . . 1.8100000000000001 110.995 -179.759 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.578 ' O ' HD22 ' A' ' 28' ' ' LEU . 4.7 t70 -79.33 0.42 29.07 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 121.175 0.512 . . . . 0.89000000000000001 110.529 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.5 -36.32 7.0 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.423 -0.808 . . . . 0.47999999999999998 111.211 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mt -90.76 40.97 1.04 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.438 0.637 . . . . 2.2000000000000002 109.607 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.747 ' HG ' ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -78.62 82.12 4.88 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 115.164 -0.925 . . . . 2.2999999999999998 111.835 -179.048 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.688 ' HZ ' ' HB2' ' A' ' 78' ' ' ALA . 0.9 OUTLIER -130.29 76.22 1.71 Allowed 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 117.421 -1.711 . . . . 2.3500000000000001 112.466 178.355 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.856 ' H ' ' H ' ' A' ' 35' ' ' TYR 0.263 0.0 OUTLIER -170.66 172.57 5.76 Favored 'General case' 0 CA--C 1.479 -1.757 0 N-CA-C 120.379 3.474 . . . . 4.6900000000000004 120.379 175.78 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 1.091 ' HA ' ' HA ' ' A' ' 140' ' ' VAL . 7.0 p 103.56 -152.56 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.593 1 CA-C-N 108.337 -4.029 . . . . 2.3799999999999999 108.854 -179.004 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.698 ' HG3' ' HG ' ' A' ' 31' ' ' SER . 0.0 OUTLIER -58.79 -1.13 0.13 Allowed 'General case' 0 N--CA 1.425 -1.724 0 CA-C-N 113.429 -1.714 . . . . 3.7999999999999998 106.398 173.193 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.747 ' H ' ' C ' ' A' ' 31' ' ' SER . 15.3 t -162.22 -134.67 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 113.873 -1.512 . . . . 2.27 110.548 -177.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.694 ' HA ' ' N ' ' A' ' 30' ' ' MET . 0.3 OUTLIER -119.5 109.39 15.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.552 1.141 . . . . 2.6699999999999999 109.069 179.801 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.856 ' H ' ' H ' ' A' ' 30' ' ' MET . 30.0 m-85 -131.1 150.57 76.93 Favored Pre-proline 0 N--CA 1.467 0.382 0 N-CA-C 113.149 0.796 . . . . 1.25 113.149 -178.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.574 ' CA ' ' HB2' ' A' ' 28' ' ' LEU . 1.8 Cg_endo -87.46 152.49 7.78 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 124.683 3.589 . . . . 0.63 113.757 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.585 ' HD1' ' HB ' ' A' ' 138' ' ' THR . 10.9 m-85 -80.97 120.6 24.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.603 -1.181 . . . . 0.48999999999999999 112.534 -178.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.431 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 6.5 mt-10 -102.95 123.91 47.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.474 -1.239 . . . . 1.74 110.0 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.85 ' HA ' ' HA ' ' A' ' 136' ' ' ILE . 0.6 OUTLIER -83.25 150.5 4.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.128 -0.487 . . . . 1.0600000000000001 111.606 -178.907 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.587 ' CZ ' ' HB3' ' A' ' 137' ' ' SER . 0.0 OUTLIER -158.43 141.97 15.2 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.524 0.935 . . . . 1.1499999999999999 113.524 178.887 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.575 ' HA ' ' O ' ' A' ' 133' ' ' LEU . 3.3 tt -76.6 133.33 39.68 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 114.427 -1.26 . . . . 2.1800000000000002 110.996 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.72 ' O ' ' HA ' ' A' ' 133' ' ' LEU . 11.0 m95 -135.65 128.88 31.9 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 114.456 1.28 . . . . 0.64000000000000001 114.456 -178.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.749 ' HA ' HD11 ' A' ' 133' ' ' LEU . 3.1 mt-10 -82.48 -3.9 56.58 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.114 -0.948 . . . . 2.8700000000000001 110.51 177.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -104.41 -13.75 25.66 Favored Glycine 0 C--N 1.332 0.352 0 N-CA-C 111.215 -0.754 . . . . 1.3400000000000001 111.215 178.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.717 ' HB3' ' ND2' ' A' ' 132' ' ' ASN . 5.8 t -58.77 -178.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.2 -0.5 . . . . 2.0699999999999998 110.885 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.897 ' HB3' ' HB2' ' A' ' 132' ' ' ASN . . . 84.68 159.79 0.11 Allowed Pre-proline 0 N--CA 1.472 0.658 0 C-N-CA 122.987 0.515 . . . . 1.6399999999999999 111.33 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -67.54 105.87 1.15 Allowed 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.401 2.067 . . . . 2.0800000000000001 111.451 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.645 ' CG ' ' HB ' ' A' ' 53' ' ' ILE . 95.4 Cg_endo -100.41 -127.24 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 123.77 2.98 . . . . 1.3 112.331 -179.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 24.6 t -69.26 -40.54 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 109.075 -0.713 . . . . 1.5600000000000001 109.075 178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.456 ' O ' ' N ' ' A' ' 52' ' ' GLU . 3.1 m -165.33 152.96 10.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.057 -0.974 . . . . 1.6299999999999999 109.107 178.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.429 ' O ' ' HB3' ' A' ' 52' ' ' GLU . 22.1 m80 -61.32 83.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.698 -0.482 . . . . 2.4399999999999999 109.698 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.761 ' HB2' HE22 ' A' ' 62' ' ' GLN . 9.7 pt-20 171.12 -6.87 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 115.919 -0.582 . . . . 1.75 111.125 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.742 ' HA ' HE21 ' A' ' 56' ' ' GLN . 0.3 OUTLIER -55.61 -42.75 70.24 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-O 120.814 0.34 . . . . 1.5900000000000001 111.331 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.571 ' HA ' ' HG3' ' A' ' 57' ' ' GLN . 7.9 t -49.25 -30.8 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-O 121.374 0.607 . . . . 1.2 109.863 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.886 ' HB3' ' H ' ' A' ' 61' ' ' GLY . 43.5 mt -60.9 -59.61 5.1 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.318 -0.855 . . . . 1.49 111.121 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.742 HE21 ' HA ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -47.74 -24.91 1.06 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.063 0.459 . . . . 0.63 111.698 -179.381 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.571 ' HG3' ' HA ' ' A' ' 54' ' ' VAL . 0.3 OUTLIER -82.02 -28.42 32.55 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.997 -0.547 . . . . 0.68999999999999995 111.102 -179.287 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.13 -84.21 0.48 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.4 -0.364 . . . . 1.6799999999999999 111.834 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.422 ' CA ' HD21 ' A' ' 115' ' ' LEU . . . -121.99 -1.25 10.58 Favored Glycine 0 C--N 1.334 0.447 0 C-N-CA 120.911 -0.662 . . . . 0.72999999999999998 112.825 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.667 ' HA ' ' HB3' ' A' ' 55' ' ' LEU . 0.0 OUTLIER 50.64 96.6 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.542 0.737 . . . . 3.3700000000000001 111.87 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.886 ' H ' ' HB3' ' A' ' 55' ' ' LEU . . . -56.84 -33.23 63.05 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 120.73 -0.748 . . . . 1.71 112.626 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.761 HE22 ' HB2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -73.54 6.71 2.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.177 0.513 . . . . 1.52 110.426 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.439 ' H ' ' C ' ' A' ' 61' ' ' GLY . 0.5 OUTLIER -147.29 -1.28 0.64 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.473 -0.785 . . . . 1.76 110.319 -179.822 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.571 ' CB ' ' HB3' ' A' ' 115' ' ' LEU . . . -108.13 171.75 4.3 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.471 -0.786 . . . . 1.4299999999999999 111.048 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.509 ' CG ' ' HG2' ' A' ' 117' ' ' GLU . 22.8 Cg_exo -60.62 -20.32 64.32 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.218 1.945 . . . . 1.1000000000000001 112.576 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.925 ' HB3' ' O ' ' A' ' 114' ' ' ARG . 0.3 OUTLIER -132.05 179.94 5.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 113.098 0.777 . . . . 6.3099999999999996 113.098 -179.654 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -124.81 -174.3 3.0 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.332 -0.849 . . . . 5.1200000000000001 112.952 -175.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.574 ' HA ' ' HA ' ' A' ' 113' ' ' TYR . 0.8 OUTLIER -91.4 125.74 44.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.403 -1.271 . . . . 1.8899999999999999 113.206 -179.421 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.621 HG22 ' HB ' ' A' ' 112' ' ' VAL . 0.0 OUTLIER -101.84 -172.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 114.636 -1.166 . . . . 1.47 108.676 177.062 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.423 ' CB ' ' HB2' ' A' ' 73' ' ' SER . 0.4 OUTLIER -130.15 154.97 46.97 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.608 0.966 . . . . 1.1399999999999999 113.608 -178.109 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.977 HG13 ' HB2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -41.11 -46.38 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 115.234 -0.893 . . . . 1.21 111.105 179.292 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.765 ' N ' HG23 ' A' ' 71' ' ' ILE . 10.7 p-10 -86.76 -25.99 24.4 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 115.305 -0.861 . . . . 1.53 110.153 -179.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.435 ' HA ' ' HB2' ' A' ' 76' ' ' SER . 0.4 OUTLIER -71.61 -59.3 2.83 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 112.621 0.6 . . . . 1.3300000000000001 112.621 -179.591 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.607 ' O ' ' HG3' ' A' ' 77' ' ' ARG . 17.5 t80 -62.63 -40.61 97.53 Favored 'General case' 0 CA--C 1.516 -0.343 0 C-N-CA 118.767 -1.173 . . . . 0.87 109.366 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.604 ' O ' ' HB3' ' A' ' 78' ' ' ALA . 23.1 m-85 -86.03 8.81 19.19 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.578 -0.737 . . . . 0.32000000000000001 109.941 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.591 ' HB2' ' O ' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -75.49 -55.18 5.93 Favored 'General case' 0 CA--C 1.499 -1.003 0 N-CA-C 106.683 -1.599 . . . . 1.1599999999999999 106.683 176.543 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -53.88 -13.75 0.82 Allowed 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 114.472 -1.24 . . . . 3.0600000000000001 107.763 176.681 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.688 ' HB2' ' HZ ' ' A' ' 29' ' ' PHE . . . -91.46 99.58 12.5 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.138 -1.392 . . . . 1.04 109.168 177.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.594 HG21 HG21 ' A' ' 93' ' ' VAL . 5.7 m 96.48 -9.36 0.08 Allowed 'General case' 0 N--CA 1.468 0.468 0 O-C-N 124.077 0.861 . . . . 1.5800000000000001 110.758 -178.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.49 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.9 OUTLIER -63.55 136.85 96.89 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-O 121.082 0.468 . . . . 1.6599999999999999 111.834 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.997 ' HB3' ' HB2' ' A' ' 85' ' ' TYR . 32.0 Cg_exo -65.72 123.52 11.48 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.826 3.017 . . . . 0.98999999999999999 113.07 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.467 ' O ' ' HB2' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -48.03 -36.53 13.05 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.144 -1.058 . . . . 2.7200000000000002 108.144 178.413 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.467 ' HB2' ' O ' ' A' ' 82' ' ' GLN . 0.3 OUTLIER 164.27 -27.14 0.0 OUTLIER 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 114.44 -1.254 . . . . 3.3100000000000001 111.631 178.1 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.569 ' O ' ' C ' ' A' ' 85' ' ' TYR . 2.8 p90 -105.8 -40.7 5.64 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.455 0.909 . . . . 3.9900000000000002 113.455 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.997 ' HB2' ' HB3' ' A' ' 81' ' ' PRO . 1.2 m-30 12.52 -100.88 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 O-C-N 123.609 0.568 . . . . 4.6500000000000004 110.69 -179.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.925 ' HG2' ' N ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -147.66 134.71 20.34 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.22 -1.4 . . . . 3.7999999999999998 107.22 176.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -42.3 -42.95 3.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.175 0.512 . . . . 3.2999999999999998 110.801 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.613 ' HG2' ' HG3' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -86.3 -20.92 27.68 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.533 -0.758 . . . . 3.6299999999999999 111.137 179.405 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.925 ' N ' ' HG2' ' A' ' 86' ' ' GLU . 2.5 mt-10 -68.73 -27.6 66.07 Favored 'General case' 0 CA--C 1.489 -1.386 0 CA-C-O 121.189 0.519 . . . . 2.2200000000000002 109.734 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.881 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 3.8 m120 -52.84 -47.88 67.41 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 106.099 -1.815 . . . . 2.1499999999999999 106.099 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.563 ' O ' ' HD3' ' A' ' 95' ' ' LYS . . . -89.42 -19.43 25.17 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.15 -1.386 . . . . 1.5 111.668 177.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.921 ' HB ' ' HA ' ' A' ' 89' ' ' GLU . 3.2 t -84.59 -51.96 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.631 0 CA-C-O 121.695 0.76 . . . . 1.6399999999999999 109.208 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.594 HG21 HG21 ' A' ' 79' ' ' THR . 0.4 OUTLIER -54.15 -40.27 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.27 0 CA-C-N 114.798 -1.092 . . . . 1.3100000000000001 108.937 178.408 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.544 ' HA ' ' NE2' ' A' ' 97' ' ' GLN . . . -61.76 -35.93 79.57 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 116.038 -0.528 . . . . 1.27 109.59 178.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.708 ' HG2' ' HA ' ' A' ' 92' ' ' VAL . 10.0 mmmt -49.84 -33.03 15.62 Favored 'General case' 0 C--N 1.343 0.306 0 N-CA-C 108.842 -0.799 . . . . 1.8700000000000001 108.842 178.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.493 ' HB3' HG22 ' A' ' 79' ' ' THR . 1.8 t80 -69.22 -52.89 23.3 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.749 -0.659 . . . . 1.0700000000000001 109.236 178.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.608 ' HG2' ' O ' ' A' ' 78' ' ' ALA . 48.8 mt-30 -45.63 -30.3 1.49 Allowed 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.916 0.865 . . . . 0.51000000000000001 108.834 177.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 95' ' ' LYS . 3.6 mtmm -77.69 -54.78 5.97 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 114.525 -1.216 . . . . 2.04 109.818 178.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.606 ' O ' ' HB ' ' A' ' 103' ' ' ILE . 0.9 OUTLIER -50.51 -20.88 1.28 Allowed 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.384 -0.826 . . . . 2.4399999999999999 109.971 179.06 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.736 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -74.57 -57.42 3.94 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.646 -0.706 . . . . 1.23 110.099 179.172 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.977 ' HB2' HG13 ' A' ' 71' ' ' ILE . 1.6 pt-20 -61.63 -36.98 82.32 Favored 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 119.744 -0.782 . . . . 2.7200000000000002 111.809 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.668 ' O ' ' HA ' ' A' ' 106' ' ' ASN . 2.7 p -85.44 -34.21 8.43 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 CA-C-N 115.112 -0.949 . . . . 1.23 113.554 -177.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.606 ' HB ' ' O ' ' A' ' 99' ' ' LEU . 0.4 OUTLIER -98.96 -30.77 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 120.55 -0.46 . . . . 2.2799999999999998 111.486 179.189 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.749 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 29.1 mmtt -85.69 -44.07 12.87 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.492 0.187 . . . . 2.21 110.971 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.769 ' HA ' HD11 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -86.66 -44.46 11.83 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.054 -1.091 . . . . 1.4299999999999999 108.054 178.443 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.668 ' HA ' ' O ' ' A' ' 102' ' ' VAL . 1.9 m-80 74.07 -45.93 0.61 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.788 -1.551 . . . . 0.5 110.302 179.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.926 ' HB3' HD11 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -72.82 170.63 14.27 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 114.644 -1.162 . . . . 2.0099999999999998 108.019 178.272 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.53 ' HB3' ' H ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -41.61 127.67 3.14 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 109.778 -0.452 . . . . 2.25 109.778 -178.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . 0.866 ' HB3' HG22 ' A' ' 71' ' ' ILE . 3.5 m120 -41.12 98.03 0.16 Allowed Pre-proline 0 C--N 1.317 -0.815 0 O-C-N 124.257 0.973 . . . . 0.40999999999999998 110.689 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.815 ' HB2' HG11 ' A' ' 124' ' ' VAL . 74.1 Cg_exo -48.22 157.47 1.23 Allowed 'Trans proline' 0 CA--C 1.509 -0.728 0 C-N-CA 122.427 2.085 . . . . 0.68000000000000005 112.126 -179.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.699 ' O ' ' HA ' ' A' ' 124' ' ' VAL . 0.0 OUTLIER -106.06 125.46 51.03 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.519 -0.764 . . . . 0.63 109.393 179.396 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.648 ' CG1' HG11 ' A' ' 122' ' ' VAL . 2.6 t -79.33 145.04 9.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.538 0.209 . . . . 1.95 111.329 -178.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.873 ' HB3' HD23 ' A' ' 55' ' ' LEU . 38.8 m-85 -135.88 117.35 14.77 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 122.339 0.256 . . . . 0.85999999999999999 110.739 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.925 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 5.3 mtp85 -113.19 117.47 32.0 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 120.528 -0.469 . . . . 2.0299999999999998 110.271 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.826 HD22 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -138.54 113.17 8.97 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 124.248 0.968 . . . . 1.6000000000000001 109.979 177.617 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.636 ' HA3' ' HA ' ' A' ' 120' ' ' LEU . . . 159.34 143.42 3.66 Favored Glycine 0 CA--C 1.498 -1.002 0 C-N-CA 120.173 -1.013 . . . . 0.54000000000000004 111.009 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.729 ' HA ' ' HA ' ' A' ' 143' ' ' THR . 0.9 OUTLIER -104.47 106.18 16.57 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.415 -0.514 . . . . 2.0600000000000001 112.303 -178.508 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.585 ' O ' ' HA ' ' A' ' 141' ' ' VAL . 85.6 t 105.6 -51.04 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.982 1.313 . . . . 1.1399999999999999 110.263 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -143.45 75.45 1.48 Allowed 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 108.806 -0.813 . . . . 1.6899999999999999 108.806 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.636 ' HA ' ' HA3' ' A' ' 116' ' ' GLY . 4.7 pp -71.58 172.15 10.13 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.753 -1.112 . . . . 1.3600000000000001 111.66 -178.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -113.75 125.84 54.56 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.059 -1.428 . . . . 1.4199999999999999 109.04 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . 0.82 HG13 HG22 ' A' ' 138' ' ' THR . 1.4 t -98.32 135.81 31.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.016 0.436 . . . . 1.77 111.457 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' TYR . . . . . 0.543 ' O ' ' HA ' ' A' ' 112' ' ' VAL . 20.5 m-85 -124.01 138.64 54.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.482 -0.781 . . . . 1.8500000000000001 109.893 178.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.815 HG11 ' HB2' ' A' ' 110' ' ' PRO . 0.2 OUTLIER -135.79 118.79 22.78 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 N-CA-C 108.876 -0.787 . . . . 1.05 108.876 178.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.766 ' HA ' ' HA3' ' A' ' 135' ' ' GLY . 0.2 OUTLIER -140.95 128.67 22.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.603 0.716 . . . . 1.0900000000000001 111.458 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.416 ' HA3' ' O ' ' A' ' 108' ' ' LYS . . . -99.82 -164.2 29.06 Favored Glycine 0 N--CA 1.43 -1.724 0 CA-C-N 114.635 -1.166 . . . . 0.23000000000000001 110.392 178.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.737 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 1.7 pt-20 -145.73 94.39 2.48 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 114.249 1.203 . . . . 1.03 114.249 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' THR . . . . . 1.014 ' H ' ' HD3' ' A' ' 129' ' ' PRO . 0.0 OUTLIER -170.46 27.56 0.01 OUTLIER Pre-proline 0 C--N 1.312 -1.062 0 CA-C-N 114.612 -1.176 . . . . 1.8200000000000001 112.396 174.128 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 1.064 ' HB3' ' HA ' ' A' ' 12' ' ' THR . 6.3 Cg_exo -82.1 -48.77 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.021 0 N-CA-C 107.478 -1.778 . . . . 0.75 107.478 176.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.594 ' H ' ' HD2' ' A' ' 129' ' ' PRO . . . -125.88 -5.13 6.9 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 111.939 -2.391 . . . . 1.3400000000000001 105.839 174.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.457 ' H ' ' HD2' ' A' ' 129' ' ' PRO . . . 124.78 12.47 4.05 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 113.543 -1.662 . . . . 0.82999999999999996 109.793 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.912 ' H ' ' HD2' ' A' ' 129' ' ' PRO . 0.5 OUTLIER 158.96 108.76 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.663 0 CA-C-O 118.139 -0.934 . . . . 1.7 110.379 -178.59 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.749 HD11 ' HA ' ' A' ' 43' ' ' GLU . 1.0 OUTLIER 153.03 44.35 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 118.174 -0.917 . . . . 3.96 113.186 178.309 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.594 ' O ' HD11 ' A' ' 107' ' ' LEU . . . -177.64 136.18 0.19 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 120.753 1.615 . . . . 1.04 114.241 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.766 ' HA3' ' HA ' ' A' ' 125' ' ' ILE . . . -165.44 -140.5 2.89 Favored Glycine 0 C--O 1.213 -1.21 0 CA-C-O 119.463 -0.632 . . . . 0.40000000000000002 111.792 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.85 ' HA ' ' HA ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -138.34 -172.98 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 117.614 0.707 . . . . 1.23 110.516 179.17 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.587 ' HB3' ' CZ ' ' A' ' 40' ' ' PHE . 65.7 p -171.33 152.06 3.24 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.145 0.794 . . . . 1.6599999999999999 113.145 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 0.82 HG22 HG13 ' A' ' 122' ' ' VAL . 14.9 t -148.39 165.03 32.33 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.282 -0.417 . . . . 1.24 111.724 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.893 ' HG3' ' HB2' ' A' ' 31' ' ' SER . 0.1 OUTLIER -94.84 161.71 14.05 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.473 -0.936 . . . . 2.1899999999999999 108.473 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . 1.091 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 1.1 t -160.6 129.04 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 114.425 1.268 . . . . 1.4299999999999999 114.425 -178.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.651 ' HB ' ' HB3' ' A' ' 32' ' ' GLU . 7.7 p -75.45 92.07 0.82 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.093 0 N-CA-C 108.889 -0.782 . . . . 2.1099999999999999 108.889 175.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.557 ' HB3' ' CE1' ' A' ' 66' ' ' PHE . 25.5 mm-40 -152.94 149.87 28.68 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.571 -0.452 . . . . 2.3199999999999998 111.22 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' THR . . . . . 0.729 ' HA ' ' HA ' ' A' ' 117' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.328 -0.844 . . . . 3.7599999999999998 111.105 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.799 0.333 . . . . 17.85 111.189 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 24.3 p80 -74.83 155.77 37.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.208 -0.451 . . . . 18.27 110.919 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -95.21 20.52 9.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.1 -0.5 . . . . 15.24 110.886 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 56.22 -157.72 0.25 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.171 -0.468 . . . . 17.07 110.915 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.11 57.37 4.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.307 -0.406 . . . . 14.05 110.724 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.44 15.5 0.7 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.995 -0.548 . . . . 10.02 110.685 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -78.69 136.02 37.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.073 -0.512 . . . . 9.4 111.083 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 136.78 -47.73 0.95 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.614 -0.803 . . . . 5.53 112.877 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.2 m -72.77 81.84 1.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.867 0.365 . . . . 5.91 110.981 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.572 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -127.85 121.65 30.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.075 -0.512 . . . . 2.54 110.855 179.511 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.778 ' HB3' ' O ' ' A' ' 128' ' ' THR . 0.2 OUTLIER 166.76 37.29 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.716 0.769 . . . . 1.49 109.392 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . 1.138 ' HA ' ' HB3' ' A' ' 129' ' ' PRO . 0.0 OUTLIER -68.33 -172.22 0.31 Allowed 'General case' 0 CA--C 1.5 -0.975 0 CA-C-N 114.926 -1.034 . . . . 0.42 110.466 179.936 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.847 ' HA ' ' HB ' ' A' ' 16' ' ' ILE . 14.1 t30 -59.14 -16.22 18.75 Favored 'General case' 0 C--O 1.213 -0.819 0 N-CA-C 106.495 -1.668 . . . . 0.88 106.495 176.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.514 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 30.5 t -53.96 -59.09 5.1 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.383 -0.969 . . . . 0.83 108.383 177.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.472 ' HB2' ' HD3' ' A' ' 11' ' ' LYS . 16.1 mt-10 -81.19 -38.85 26.39 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 114.785 -1.098 . . . . 2.02 109.114 178.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 1.017 HD11 ' HB3' ' A' ' 107' ' ' LEU . 0.9 OUTLIER -59.17 -25.76 31.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 115.312 -0.858 . . . . 0.38 111.433 -179.685 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.739 ' O ' ' HB2' ' A' ' 21' ' ' LYS . 1.1 pp -83.86 -31.27 25.85 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.503 -0.925 . . . . 0.51 108.503 176.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.819 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -65.38 -60.42 2.98 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 114.888 -1.051 . . . . 2.07 112.823 -179.302 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.894 ' NE2' ' HA ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -69.71 -45.49 68.09 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 116.249 1.944 . . . . 1.84 116.249 -177.188 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.851 HD11 ' OG ' ' A' ' 105' ' ' SER . 9.7 mt -85.03 -22.64 28.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.413 1.264 . . . . 0.38 114.413 -176.245 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.739 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 3.1 mmpt? -89.99 -27.36 19.82 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 119.915 -0.714 . . . . 0.89 110.352 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.819 ' HB3' ' O ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -85.55 -49.95 7.63 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.372 -0.831 . . . . 2.77 111.936 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.503 ' HB3' ' HD2' ' A' ' 104' ' ' LYS . . . -97.97 -52.68 3.63 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 112.608 0.595 . . . . 0.36 112.608 -177.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.582 ' HB2' ' HA ' ' A' ' 20' ' ' LEU . 0.9 OUTLIER -57.86 -14.9 6.88 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.775 -0.37 . . . . 1.22 110.995 -179.759 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 21' ' ' LYS . 4.7 t70 -79.33 0.42 29.07 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 121.175 0.512 . . . . 0.89 110.529 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.5 -36.32 7.0 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.423 -0.808 . . . . 0.48 111.211 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.407 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . 1.1 mt -90.76 40.97 1.04 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.438 0.637 . . . . 1.62 109.607 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.877 HD13 ' HG3' ' A' ' 36' ' ' PRO . 0.3 OUTLIER -78.62 82.12 4.88 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 115.164 -0.925 . . . . 1.67 111.835 -179.048 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.564 ' HZ ' ' HB1' ' A' ' 78' ' ' ALA . 0.9 OUTLIER -130.29 76.22 1.71 Allowed 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 117.421 -1.711 . . . . 1.98 112.466 178.355 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.87 ' H ' ' H ' ' A' ' 35' ' ' TYR 0.263 0.0 OUTLIER -170.66 172.57 5.76 Favored 'General case' 0 CA--C 1.479 -1.757 0 N-CA-C 120.379 3.474 . . . . 4.18 120.379 175.78 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . 1.05 ' HA ' ' HA ' ' A' ' 140' ' ' VAL . 7.0 p 103.56 -152.56 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.593 1 CA-C-N 108.337 -4.029 . . . . 1.98 108.854 -179.004 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.676 ' HB3' ' HB ' ' A' ' 141' ' ' VAL . 0.0 OUTLIER -58.79 -1.13 0.13 Allowed 'General case' 0 N--CA 1.425 -1.724 0 CA-C-N 113.429 -1.714 . . . . 3.8 106.398 173.193 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.737 ' H ' ' C ' ' A' ' 31' ' ' SER . 15.3 t -162.22 -134.67 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 113.873 -1.512 . . . . 2.02 110.548 -177.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.72 ' HA ' ' N ' ' A' ' 30' ' ' MET . 0.3 OUTLIER -119.5 109.39 15.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.552 1.141 . . . . 2.67 109.069 179.801 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.87 ' H ' ' H ' ' A' ' 30' ' ' MET . 30.0 m-85 -131.1 150.57 76.93 Favored Pre-proline 0 N--CA 1.467 0.382 0 N-CA-C 113.149 0.796 . . . . 1.08 113.149 -178.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.877 ' HG3' HD13 ' A' ' 28' ' ' LEU . 1.8 Cg_endo -87.46 152.49 7.78 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 124.683 3.589 . . . . 0.56 113.757 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.6 ' HA ' ' O ' ' A' ' 137' ' ' SER . 10.9 m-85 -80.97 120.6 24.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.603 -1.181 . . . . 0.49 112.534 -178.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.438 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 6.5 mt-10 -102.95 123.91 47.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.474 -1.239 . . . . 1.7 110.0 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.886 ' HA ' ' HA ' ' A' ' 136' ' ' ILE . 0.6 OUTLIER -83.25 150.5 4.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.128 -0.487 . . . . 0.25 111.606 -178.907 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.6 ' CZ ' ' HB3' ' A' ' 137' ' ' SER . 0.0 OUTLIER -158.43 141.97 15.2 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.524 0.935 . . . . 0.85 113.524 178.887 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.889 HD11 HD23 ' A' ' 133' ' ' LEU . 3.3 tt -76.6 133.33 39.68 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 114.427 -1.26 . . . . 1.65 110.996 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 1.057 ' HB2' HG21 ' A' ' 125' ' ' ILE . 11.0 m95 -135.65 128.88 31.9 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 114.456 1.28 . . . . 0.64 114.456 -178.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.686 ' HA ' ' CD1' ' A' ' 133' ' ' LEU . 3.1 mt-10 -82.48 -3.9 56.58 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.114 -0.948 . . . . 2.87 110.51 177.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -104.41 -13.75 25.66 Favored Glycine 0 C--N 1.332 0.352 0 N-CA-C 111.215 -0.754 . . . . 1.34 111.215 178.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.58 ' HB3' ' OD1' ' A' ' 132' ' ' ASN . 5.8 t -58.77 -178.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.2 -0.5 . . . . 1.41 110.885 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.939 ' HB2' ' HB2' ' A' ' 132' ' ' ASN . . . 84.68 159.79 0.11 Allowed Pre-proline 0 N--CA 1.472 0.658 0 C-N-CA 122.987 0.515 . . . . 1.15 111.33 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -67.54 105.87 1.15 Allowed 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.401 2.067 . . . . 1.8 111.451 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.681 ' HG2' ' HB ' ' A' ' 53' ' ' ILE . 95.4 Cg_endo -100.41 -127.24 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 123.77 2.98 . . . . 1.3 112.331 -179.066 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.447 ' H ' ' HB2' ' A' ' 48' ' ' PRO . 24.6 t -69.26 -40.54 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 109.075 -0.713 . . . . 1.14 109.075 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.456 ' O ' ' N ' ' A' ' 52' ' ' GLU . 3.1 m -165.33 152.96 10.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.057 -0.974 . . . . 1.24 109.107 178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.421 ' O ' ' HB3' ' A' ' 52' ' ' GLU . 22.1 m80 -61.32 83.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.698 -0.482 . . . . 1.66 109.698 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.736 ' HB2' HD12 ' A' ' 55' ' ' LEU . 9.7 pt-20 171.12 -6.87 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 115.919 -0.582 . . . . 1.74 111.125 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.783 ' HA ' HE21 ' A' ' 56' ' ' GLN . 0.3 OUTLIER -55.61 -42.75 70.24 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-O 120.814 0.34 . . . . 0.97 111.331 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.6 ' HA ' ' HG3' ' A' ' 57' ' ' GLN . 7.9 t -49.25 -30.8 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-O 121.374 0.607 . . . . 0.52 109.863 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.864 ' HB3' ' H ' ' A' ' 61' ' ' GLY . 43.5 mt -60.9 -59.61 5.1 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.318 -0.855 . . . . 0.85 111.121 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.783 HE21 ' HA ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -47.74 -24.91 1.06 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.063 0.459 . . . . 0.63 111.698 -179.381 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.6 ' HG3' ' HA ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -82.02 -28.42 32.55 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.997 -0.547 . . . . 0.59 111.102 -179.287 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.13 -84.21 0.48 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.4 -0.364 . . . . 1.04 111.834 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.584 ' O ' ' HB2' ' A' ' 64' ' ' ALA . . . -121.99 -1.25 10.58 Favored Glycine 0 C--N 1.334 0.447 0 C-N-CA 120.911 -0.662 . . . . 0.73 112.825 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.681 ' HA ' ' HB3' ' A' ' 55' ' ' LEU . 0.0 OUTLIER 50.64 96.6 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.542 0.737 . . . . 2.52 111.87 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.864 ' H ' ' HB3' ' A' ' 55' ' ' LEU . . . -56.84 -33.23 63.05 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 120.73 -0.748 . . . . 1.71 112.626 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.429 HE21 ' HB3' ' A' ' 62' ' ' GLN . 0.0 OUTLIER -73.54 6.71 2.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.177 0.513 . . . . 1.37 110.426 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.403 ' H ' ' C ' ' A' ' 61' ' ' GLY . 0.5 OUTLIER -147.29 -1.28 0.64 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.473 -0.785 . . . . 1.76 110.319 -179.822 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.585 ' CB ' ' HB3' ' A' ' 115' ' ' LEU . . . -108.13 171.75 4.3 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.471 -0.786 . . . . 0.81 111.048 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.534 ' HD2' ' HB1' ' A' ' 64' ' ' ALA . 22.8 Cg_exo -60.62 -20.32 64.32 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.218 1.945 . . . . 0.91 112.576 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.946 ' HB3' ' O ' ' A' ' 114' ' ' ARG . 0.3 OUTLIER -132.05 179.94 5.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 113.098 0.777 . . . . 5.42 113.098 -179.654 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -124.81 -174.3 3.0 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.332 -0.849 . . . . 4.49 112.952 -175.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.704 HG11 ' HB3' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -91.4 125.74 44.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.403 -1.271 . . . . 1.39 113.206 -179.421 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.665 HG23 ' HB ' ' A' ' 112' ' ' VAL . 0.0 OUTLIER -101.84 -172.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 114.636 -1.166 . . . . 0.81 108.676 177.062 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.654 ' C ' HG23 ' A' ' 112' ' ' VAL . 0.4 OUTLIER -130.15 154.97 46.97 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.608 0.966 . . . . 1.14 113.608 -178.109 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 1.054 HG21 ' HB3' ' A' ' 109' ' ' ASN . 0.0 OUTLIER -41.11 -46.38 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 115.234 -0.893 . . . . 0.61 111.105 179.292 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.578 ' N ' ' CG2' ' A' ' 71' ' ' ILE . 10.7 p-10 -86.76 -25.99 24.4 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 115.305 -0.861 . . . . 1.53 110.153 -179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.475 ' HA ' ' HB2' ' A' ' 76' ' ' SER . 0.4 OUTLIER -71.61 -59.3 2.83 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 112.621 0.6 . . . . 0.9 112.621 -179.591 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.61 ' O ' ' HG3' ' A' ' 77' ' ' ARG . 17.5 t80 -62.63 -40.61 97.53 Favored 'General case' 0 CA--C 1.516 -0.343 0 C-N-CA 118.767 -1.173 . . . . 0.66 109.366 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.717 ' O ' ' HB3' ' A' ' 78' ' ' ALA . 23.1 m-85 -86.03 8.81 19.19 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.578 -0.737 . . . . 0.32 109.941 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.575 ' HB2' ' O ' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -75.49 -55.18 5.93 Favored 'General case' 0 CA--C 1.499 -1.003 0 N-CA-C 106.683 -1.599 . . . . 0.81 106.683 176.543 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.61 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -53.88 -13.75 0.82 Allowed 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 114.472 -1.24 . . . . 2.41 107.763 176.681 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.717 ' HB3' ' O ' ' A' ' 75' ' ' PHE . . . -91.46 99.58 12.5 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.138 -1.392 . . . . 0.53 109.168 177.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.958 HG22 HG22 ' A' ' 93' ' ' VAL . 5.7 m 96.48 -9.36 0.08 Allowed 'General case' 0 N--CA 1.468 0.468 0 O-C-N 124.077 0.861 . . . . 0.75 110.758 -178.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.493 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.9 OUTLIER -63.55 136.85 96.89 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-O 121.082 0.468 . . . . 0.86 111.834 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.995 ' HB3' ' HB2' ' A' ' 85' ' ' TYR . 32.0 Cg_exo -65.72 123.52 11.48 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.826 3.017 . . . . 0.99 113.07 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.459 ' O ' ' HB2' ' A' ' 83' ' ' ASP . 3.3 mp0 -48.03 -36.53 13.05 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.144 -1.058 . . . . 2.72 108.144 178.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 82' ' ' GLN . 0.3 OUTLIER 164.27 -27.14 0.0 OUTLIER 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 114.44 -1.254 . . . . 3.31 111.631 178.1 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.569 ' O ' ' C ' ' A' ' 85' ' ' TYR . 2.8 p90 -105.8 -40.7 5.64 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.455 0.909 . . . . 3.73 113.455 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.995 ' HB2' ' HB3' ' A' ' 81' ' ' PRO . 1.2 m-30 12.52 -100.88 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 O-C-N 123.609 0.568 . . . . 4.34 110.69 -179.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.944 ' HG2' ' N ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -147.66 134.71 20.34 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.22 -1.4 . . . . 3.8 107.22 176.829 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -42.3 -42.95 3.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.175 0.512 . . . . 3.3 110.801 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.644 ' HG2' ' HG3' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -86.3 -20.92 27.68 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.533 -0.758 . . . . 3.63 111.137 179.405 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.969 ' HA ' ' HB ' ' A' ' 92' ' ' VAL . 2.5 mt-10 -68.73 -27.6 66.07 Favored 'General case' 0 CA--C 1.489 -1.386 0 CA-C-O 121.189 0.519 . . . . 2.22 109.734 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.967 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 3.8 m120 -52.84 -47.88 67.41 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 106.099 -1.815 . . . . 2.15 106.099 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.559 ' O ' ' HD3' ' A' ' 95' ' ' LYS . . . -89.42 -19.43 25.17 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.15 -1.386 . . . . 1.08 111.668 177.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.969 ' HB ' ' HA ' ' A' ' 89' ' ' GLU . 3.2 t -84.59 -51.96 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.631 0 CA-C-O 121.695 0.76 . . . . 0.99 109.208 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.958 HG22 HG22 ' A' ' 79' ' ' THR . 0.4 OUTLIER -54.15 -40.27 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.27 0 CA-C-N 114.798 -1.092 . . . . 0.88 108.937 178.408 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.546 ' HA ' ' NE2' ' A' ' 97' ' ' GLN . . . -61.76 -35.93 79.57 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 116.038 -0.528 . . . . 0.64 109.59 178.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.713 ' HG2' ' HA ' ' A' ' 92' ' ' VAL . 10.0 mmmt -49.84 -33.03 15.62 Favored 'General case' 0 C--N 1.343 0.306 0 N-CA-C 108.842 -0.799 . . . . 1.35 108.842 178.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.52 ' HB3' HG21 ' A' ' 79' ' ' THR . 1.8 t80 -69.22 -52.89 23.3 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.749 -0.659 . . . . 0.87 109.236 178.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.626 ' HG2' ' O ' ' A' ' 78' ' ' ALA . 48.8 mt-30 -45.63 -30.3 1.49 Allowed 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.916 0.865 . . . . 0.43 108.834 177.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.539 ' HB2' ' O ' ' A' ' 95' ' ' LYS . 3.6 mtmm -77.69 -54.78 5.97 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 114.525 -1.216 . . . . 1.6 109.818 178.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.617 ' O ' ' HB ' ' A' ' 103' ' ' ILE . 0.9 OUTLIER -50.51 -20.88 1.28 Allowed 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.384 -0.826 . . . . 1.92 109.971 179.06 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.735 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -74.57 -57.42 3.94 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.646 -0.706 . . . . 0.65 110.099 179.172 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.995 ' HB2' HG13 ' A' ' 71' ' ' ILE . 1.6 pt-20 -61.63 -36.98 82.32 Favored 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 119.744 -0.782 . . . . 2.72 111.809 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.677 ' O ' ' HA ' ' A' ' 106' ' ' ASN . 2.7 p -85.44 -34.21 8.43 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 CA-C-N 115.112 -0.949 . . . . 0.68 113.554 -177.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.617 ' HB ' ' O ' ' A' ' 99' ' ' LEU . 0.4 OUTLIER -98.96 -30.77 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 120.55 -0.46 . . . . 1.72 111.486 179.189 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.76 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 29.1 mmtt -85.69 -44.07 12.87 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.492 0.187 . . . . 1.71 110.971 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.851 ' OG ' HD11 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -86.66 -44.46 11.83 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.054 -1.091 . . . . 1.09 108.054 178.443 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.677 ' HA ' ' O ' ' A' ' 102' ' ' VAL . 6.7 m120 74.07 -45.93 0.61 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.788 -1.551 . . . . 0.5 110.302 179.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 1.017 ' HB3' HD11 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -72.82 170.63 14.27 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 114.644 -1.162 . . . . 1.34 108.019 178.272 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.616 ' HB3' ' H ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -41.61 127.67 3.14 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 109.778 -0.452 . . . . 1.75 109.778 -178.859 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASN . . . . . 1.054 ' HB3' HG21 ' A' ' 71' ' ' ILE . 13.3 m-20 -41.12 98.03 0.16 Allowed Pre-proline 0 C--N 1.317 -0.815 0 O-C-N 124.257 0.973 . . . . 0.41 110.689 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.906 ' HB2' HG12 ' A' ' 124' ' ' VAL . 74.1 Cg_exo -48.22 157.47 1.23 Allowed 'Trans proline' 0 CA--C 1.509 -0.728 0 C-N-CA 122.427 2.085 . . . . 0.38 112.126 -179.277 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.706 ' O ' ' HA ' ' A' ' 124' ' ' VAL . 0.0 OUTLIER -106.06 125.46 51.03 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.519 -0.764 . . . . 0.53 109.393 179.396 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.684 ' O ' HG23 ' A' ' 68' ' ' VAL . 2.6 t -79.33 145.04 9.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.538 0.209 . . . . 1.33 111.329 -178.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.685 ' O ' ' HA ' ' A' ' 122' ' ' VAL . 38.8 m-85 -135.88 117.35 14.77 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 122.339 0.256 . . . . 0.26 110.739 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.946 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 5.3 mtp85 -113.19 117.47 32.0 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 120.528 -0.469 . . . . 1.57 110.271 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.585 ' HB3' ' CB ' ' A' ' 64' ' ' ALA . 0.0 OUTLIER -138.54 113.17 8.97 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 124.248 0.968 . . . . 0.97 109.979 177.617 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.625 ' HA3' ' HA ' ' A' ' 120' ' ' LEU . . . 159.34 143.42 3.66 Favored Glycine 0 CA--C 1.498 -1.002 0 C-N-CA 120.173 -1.013 . . . . 0.51 111.009 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.738 ' HA ' ' HA ' ' A' ' 143' ' ' THR . 0.9 OUTLIER -104.47 106.18 16.57 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.415 -0.514 . . . . 2.06 112.303 -178.508 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.56 ' O ' ' HA ' ' A' ' 141' ' ' VAL . 85.6 t 105.6 -51.04 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.982 1.313 . . . . 0.56 110.263 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.541 ' HG2' HG12 ' A' ' 118' ' ' VAL . 1.9 mt-10 -143.45 75.45 1.48 Allowed 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 108.806 -0.813 . . . . 1.69 108.806 179.066 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.625 ' HA ' ' HA3' ' A' ' 116' ' ' GLY . 4.7 pp -71.58 172.15 10.13 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.753 -1.112 . . . . 0.78 111.66 -178.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -113.75 125.84 54.56 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.059 -1.428 . . . . 1.42 109.04 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.796 ' HB ' ' O ' ' A' ' 138' ' ' THR . 1.4 t -98.32 135.81 31.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.016 0.436 . . . . 0.99 111.457 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' TYR . . . . . 0.561 ' O ' ' HA ' ' A' ' 112' ' ' VAL . 20.5 m-85 -124.01 138.64 54.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.482 -0.781 . . . . 1.15 109.893 178.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.906 HG12 ' HB2' ' A' ' 110' ' ' PRO . 0.2 OUTLIER -135.79 118.79 22.78 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 N-CA-C 108.876 -0.787 . . . . 0.26 108.876 178.925 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 1.057 HG21 ' HB2' ' A' ' 42' ' ' TRP . 0.2 OUTLIER -140.95 128.67 22.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.603 0.716 . . . . 0.49 111.458 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.451 ' HA3' ' O ' ' A' ' 108' ' ' LYS . . . -99.82 -164.2 29.06 Favored Glycine 0 N--CA 1.43 -1.724 0 CA-C-N 114.635 -1.166 . . . . 0.23 110.392 178.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.712 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 1.7 pt-20 -145.73 94.39 2.48 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 114.249 1.203 . . . . 1.03 114.249 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' THR . . . . . 1.045 ' H ' ' HD3' ' A' ' 129' ' ' PRO . 0.0 OUTLIER -170.46 27.56 0.01 OUTLIER Pre-proline 0 C--N 1.312 -1.062 0 CA-C-N 114.612 -1.176 . . . . 1.27 112.396 174.128 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 1.138 ' HB3' ' HA ' ' A' ' 12' ' ' THR . 6.3 Cg_exo -82.1 -48.77 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.021 0 N-CA-C 107.478 -1.778 . . . . 0.69 107.478 176.134 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.589 ' H ' ' HD2' ' A' ' 129' ' ' PRO . . . -125.88 -5.13 6.9 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 111.939 -2.391 . . . . 0.67 105.839 174.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.482 ' H ' ' HD2' ' A' ' 129' ' ' PRO . . . 124.78 12.47 4.05 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 113.543 -1.662 . . . . 0.83 109.793 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.995 ' H ' ' HD2' ' A' ' 129' ' ' PRO . 1.6 t30 158.96 108.76 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.663 0 CA-C-O 118.139 -0.934 . . . . 1.56 110.379 -178.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.889 HD23 HD11 ' A' ' 41' ' ' LEU . 1.0 OUTLIER 153.03 44.35 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 118.174 -0.917 . . . . 3.31 113.186 178.309 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.477 ' HB1' HG21 ' A' ' 16' ' ' ILE . . . -177.64 136.18 0.19 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 120.753 1.615 . . . . 0.46 114.241 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.786 ' HA3' ' HA ' ' A' ' 125' ' ' ILE . . . -165.44 -140.5 2.89 Favored Glycine 0 C--O 1.213 -1.21 0 CA-C-O 119.463 -0.632 . . . . 0.29 111.792 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.886 ' HA ' ' HA ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -138.34 -172.98 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 117.614 0.707 . . . . 0.52 110.516 179.17 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 137' ' ' SER . . . . . 0.601 ' HA ' HG23 ' A' ' 124' ' ' VAL . 65.7 p -171.33 152.06 3.24 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.145 0.794 . . . . 1.2 113.145 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.796 ' O ' ' HB ' ' A' ' 122' ' ' VAL . 14.9 t -148.39 165.03 32.33 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.282 -0.417 . . . . 0.73 111.724 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.913 ' HG3' ' HB2' ' A' ' 31' ' ' SER . 0.1 OUTLIER -94.84 161.71 14.05 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.473 -0.936 . . . . 1.5 108.473 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 1.05 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 1.1 t -160.6 129.04 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 114.425 1.268 . . . . 0.73 114.425 -178.428 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.676 ' HB ' ' HB3' ' A' ' 32' ' ' GLU . 7.7 p -75.45 92.07 0.82 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.093 0 N-CA-C 108.889 -0.782 . . . . 1.56 108.889 175.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.565 ' HB3' ' CE1' ' A' ' 66' ' ' PHE . 25.5 mm-40 -152.94 149.87 28.68 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.571 -0.452 . . . . 2.32 111.22 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' THR . . . . . 0.738 ' HA ' ' HA ' ' A' ' 117' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.328 -0.844 . . . . 3.3 111.105 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.799 0.333 . . . . 17.85 111.189 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 24.3 p80 -74.83 155.77 37.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.208 -0.451 . . . . 18.27 110.919 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -95.21 20.52 9.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.1 -0.5 . . . . 15.24 110.886 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 56.22 -157.72 0.25 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.171 -0.468 . . . . 17.07 110.915 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.11 57.37 4.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.307 -0.406 . . . . 14.05 110.724 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.44 15.5 0.7 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.995 -0.548 . . . . 10.02 110.685 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -78.69 136.02 37.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.073 -0.512 . . . . 9.4 111.083 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 136.78 -47.73 0.95 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.614 -0.803 . . . . 5.53 112.877 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.2 m -72.77 81.84 1.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.867 0.365 . . . . 5.91 110.981 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.572 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -127.85 121.65 30.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.075 -0.512 . . . . 2.54 110.855 179.511 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.778 ' HB3' ' O ' ' A' ' 128' ' ' THR . 0.2 OUTLIER 166.76 37.29 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.716 0.769 . . . . 1.49 109.392 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 1.138 ' HA ' ' HB3' ' A' ' 129' ' ' PRO . 0.0 OUTLIER -68.33 -172.22 0.31 Allowed 'General case' 0 CA--C 1.5 -0.975 0 CA-C-N 114.926 -1.034 . . . . 0.42 110.466 179.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.847 ' HA ' ' HB ' ' A' ' 16' ' ' ILE . 1.5 t-20 -59.14 -16.22 18.75 Favored 'General case' 0 C--O 1.213 -0.819 0 N-CA-C 106.495 -1.668 . . . . 0.88 106.495 176.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.514 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 30.5 t -53.96 -59.09 5.1 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.383 -0.969 . . . . 0.83 108.383 177.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.472 ' HB2' ' HD3' ' A' ' 11' ' ' LYS . 16.1 mt-10 -81.19 -38.85 26.39 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 114.785 -1.098 . . . . 2.02 109.114 178.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 1.017 HD11 ' HB3' ' A' ' 107' ' ' LEU . 0.9 OUTLIER -59.17 -25.76 31.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 115.312 -0.858 . . . . 0.38 111.433 -179.685 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.845 ' HB3' ' ND2' ' A' ' 13' ' ' ASN . 1.1 pp -83.86 -31.27 25.85 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.503 -0.925 . . . . 0.51 108.503 176.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.819 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -65.38 -60.42 2.98 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 114.888 -1.051 . . . . 2.07 112.823 -179.302 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.894 ' NE2' ' HA ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -69.71 -45.49 68.09 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 116.249 1.944 . . . . 1.84 116.249 -177.188 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.851 HD11 ' OG ' ' A' ' 105' ' ' SER . 9.7 mt -85.03 -22.64 28.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.413 1.264 . . . . 0.38 114.413 -176.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.739 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 3.1 mmpt? -89.99 -27.36 19.82 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 119.915 -0.714 . . . . 0.89 110.352 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.819 ' HB3' ' O ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -85.55 -49.95 7.63 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.372 -0.831 . . . . 2.77 111.936 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.503 ' HB3' ' HD2' ' A' ' 104' ' ' LYS . . . -97.97 -52.68 3.63 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 112.608 0.595 . . . . 0.36 112.608 -177.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.582 ' HB2' ' HA ' ' A' ' 20' ' ' LEU . 0.9 OUTLIER -57.86 -14.9 6.88 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.775 -0.37 . . . . 1.22 110.995 -179.759 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 21' ' ' LYS . 4.7 t70 -79.33 0.42 29.07 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 121.175 0.512 . . . . 0.89 110.529 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.5 -36.32 7.0 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.423 -0.808 . . . . 0.48 111.211 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.407 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . 1.1 mt -90.76 40.97 1.04 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.438 0.637 . . . . 1.62 109.607 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.877 HD13 ' HG3' ' A' ' 36' ' ' PRO . 0.3 OUTLIER -78.62 82.12 4.88 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 115.164 -0.925 . . . . 1.67 111.835 -179.048 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.564 ' HZ ' ' HB1' ' A' ' 78' ' ' ALA . 0.9 OUTLIER -130.29 76.22 1.71 Allowed 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 117.421 -1.711 . . . . 1.98 112.466 178.355 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.87 ' H ' ' H ' ' A' ' 35' ' ' TYR 0.263 0.0 OUTLIER -170.66 172.57 5.76 Favored 'General case' 0 CA--C 1.479 -1.757 0 N-CA-C 120.379 3.474 . . . . 4.18 120.379 175.78 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 1.05 ' HA ' ' HA ' ' A' ' 140' ' ' VAL . 7.0 p 103.56 -152.56 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.593 1 CA-C-N 108.337 -4.029 . . . . 1.98 108.854 -179.004 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.676 ' HB3' ' HB ' ' A' ' 141' ' ' VAL . 0.0 OUTLIER -58.79 -1.13 0.13 Allowed 'General case' 0 N--CA 1.425 -1.724 0 CA-C-N 113.429 -1.714 . . . . 3.8 106.398 173.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.737 ' H ' ' C ' ' A' ' 31' ' ' SER . 15.3 t -162.22 -134.67 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 113.873 -1.512 . . . . 2.02 110.548 -177.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.72 ' HA ' ' N ' ' A' ' 30' ' ' MET . 0.3 OUTLIER -119.5 109.39 15.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.552 1.141 . . . . 2.67 109.069 179.801 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.87 ' H ' ' H ' ' A' ' 30' ' ' MET . 30.0 m-85 -131.1 150.57 76.93 Favored Pre-proline 0 N--CA 1.467 0.382 0 N-CA-C 113.149 0.796 . . . . 1.08 113.149 -178.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.877 ' HG3' HD13 ' A' ' 28' ' ' LEU . 1.8 Cg_endo -87.46 152.49 7.78 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 124.683 3.589 . . . . 0.56 113.757 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.6 ' HA ' ' O ' ' A' ' 137' ' ' SER . 10.9 m-85 -80.97 120.6 24.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.603 -1.181 . . . . 0.49 112.534 -178.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.438 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 6.5 mt-10 -102.95 123.91 47.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.474 -1.239 . . . . 1.7 110.0 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.886 ' HA ' ' HA ' ' A' ' 136' ' ' ILE . 0.6 OUTLIER -83.25 150.5 4.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.128 -0.487 . . . . 0.25 111.606 -178.907 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.6 ' CZ ' ' HB3' ' A' ' 137' ' ' SER . 0.0 OUTLIER -158.43 141.97 15.2 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.524 0.935 . . . . 0.85 113.524 178.887 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.889 HD11 HD23 ' A' ' 133' ' ' LEU . 3.3 tt -76.6 133.33 39.68 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 114.427 -1.26 . . . . 1.65 110.996 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 1.057 ' HB2' HG21 ' A' ' 125' ' ' ILE . 11.0 m95 -135.65 128.88 31.9 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 114.456 1.28 . . . . 0.64 114.456 -178.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.686 ' HA ' ' CD1' ' A' ' 133' ' ' LEU . 3.1 mt-10 -82.48 -3.9 56.58 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.114 -0.948 . . . . 2.87 110.51 177.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -104.41 -13.75 25.66 Favored Glycine 0 C--N 1.332 0.352 0 N-CA-C 111.215 -0.754 . . . . 1.34 111.215 178.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.724 ' HB3' ' ND2' ' A' ' 132' ' ' ASN . 5.8 t -58.77 -178.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.2 -0.5 . . . . 1.41 110.885 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.939 ' HB2' ' HB2' ' A' ' 132' ' ' ASN . . . 84.68 159.79 0.11 Allowed Pre-proline 0 N--CA 1.472 0.658 0 C-N-CA 122.987 0.515 . . . . 1.15 111.33 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -67.54 105.87 1.15 Allowed 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.401 2.067 . . . . 1.8 111.451 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.681 ' HG2' ' HB ' ' A' ' 53' ' ' ILE . 95.4 Cg_endo -100.41 -127.24 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 123.77 2.98 . . . . 1.3 112.331 -179.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.447 ' H ' ' HB2' ' A' ' 48' ' ' PRO . 24.6 t -69.26 -40.54 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 109.075 -0.713 . . . . 1.14 109.075 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.456 ' O ' ' N ' ' A' ' 52' ' ' GLU . 3.1 m -165.33 152.96 10.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.057 -0.974 . . . . 1.24 109.107 178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.421 ' O ' ' HB3' ' A' ' 52' ' ' GLU . 22.1 m80 -61.32 83.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.698 -0.482 . . . . 1.66 109.698 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.781 ' HB2' HE22 ' A' ' 62' ' ' GLN . 9.7 pt-20 171.12 -6.87 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 115.919 -0.582 . . . . 1.74 111.125 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.783 ' HA ' HE21 ' A' ' 56' ' ' GLN . 0.3 OUTLIER -55.61 -42.75 70.24 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-O 120.814 0.34 . . . . 0.97 111.331 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.6 ' HA ' ' HG3' ' A' ' 57' ' ' GLN . 7.9 t -49.25 -30.8 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-O 121.374 0.607 . . . . 0.52 109.863 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.864 ' HB3' ' H ' ' A' ' 61' ' ' GLY . 43.5 mt -60.9 -59.61 5.1 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.318 -0.855 . . . . 0.85 111.121 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.783 HE21 ' HA ' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -47.74 -24.91 1.06 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.063 0.459 . . . . 0.63 111.698 -179.381 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.6 ' HG3' ' HA ' ' A' ' 54' ' ' VAL . 0.3 OUTLIER -82.02 -28.42 32.55 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.997 -0.547 . . . . 0.59 111.102 -179.287 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.13 -84.21 0.48 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.4 -0.364 . . . . 1.04 111.834 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.584 ' O ' ' HB2' ' A' ' 64' ' ' ALA . . . -121.99 -1.25 10.58 Favored Glycine 0 C--N 1.334 0.447 0 C-N-CA 120.911 -0.662 . . . . 0.73 112.825 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.681 ' HA ' ' HB3' ' A' ' 55' ' ' LEU . 0.0 OUTLIER 50.64 96.6 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.542 0.737 . . . . 2.52 111.87 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.864 ' H ' ' HB3' ' A' ' 55' ' ' LEU . . . -56.84 -33.23 63.05 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 120.73 -0.748 . . . . 1.71 112.626 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.781 HE22 ' HB2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -73.54 6.71 2.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.177 0.513 . . . . 1.37 110.426 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.403 ' H ' ' C ' ' A' ' 61' ' ' GLY . 0.5 OUTLIER -147.29 -1.28 0.64 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.473 -0.785 . . . . 1.76 110.319 -179.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.585 ' CB ' ' HB3' ' A' ' 115' ' ' LEU . . . -108.13 171.75 4.3 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.471 -0.786 . . . . 0.81 111.048 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.534 ' HD2' ' HB1' ' A' ' 64' ' ' ALA . 22.8 Cg_exo -60.62 -20.32 64.32 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.218 1.945 . . . . 0.91 112.576 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.946 ' HB3' ' O ' ' A' ' 114' ' ' ARG . 0.3 OUTLIER -132.05 179.94 5.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 113.098 0.777 . . . . 5.42 113.098 -179.654 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -124.81 -174.3 3.0 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.332 -0.849 . . . . 4.49 112.952 -175.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.704 HG11 ' HB3' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -91.4 125.74 44.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.403 -1.271 . . . . 1.39 113.206 -179.421 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.665 HG23 ' HB ' ' A' ' 112' ' ' VAL . 0.0 OUTLIER -101.84 -172.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 114.636 -1.166 . . . . 0.81 108.676 177.062 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.654 ' C ' HG23 ' A' ' 112' ' ' VAL . 0.4 OUTLIER -130.15 154.97 46.97 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.608 0.966 . . . . 1.14 113.608 -178.109 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 1.054 HG21 ' HB3' ' A' ' 109' ' ' ASN . 0.0 OUTLIER -41.11 -46.38 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 115.234 -0.893 . . . . 0.61 111.105 179.292 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.578 ' N ' ' CG2' ' A' ' 71' ' ' ILE . 10.7 p-10 -86.76 -25.99 24.4 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 115.305 -0.861 . . . . 1.53 110.153 -179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.475 ' HA ' ' HB2' ' A' ' 76' ' ' SER . 0.4 OUTLIER -71.61 -59.3 2.83 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 112.621 0.6 . . . . 0.9 112.621 -179.591 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.61 ' O ' ' HG3' ' A' ' 77' ' ' ARG . 17.5 t80 -62.63 -40.61 97.53 Favored 'General case' 0 CA--C 1.516 -0.343 0 C-N-CA 118.767 -1.173 . . . . 0.66 109.366 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.717 ' O ' ' HB3' ' A' ' 78' ' ' ALA . 23.1 m-85 -86.03 8.81 19.19 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.578 -0.737 . . . . 0.32 109.941 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.575 ' HB2' ' O ' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -75.49 -55.18 5.93 Favored 'General case' 0 CA--C 1.499 -1.003 0 N-CA-C 106.683 -1.599 . . . . 0.81 106.683 176.543 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.61 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -53.88 -13.75 0.82 Allowed 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 114.472 -1.24 . . . . 2.41 107.763 176.681 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.717 ' HB3' ' O ' ' A' ' 75' ' ' PHE . . . -91.46 99.58 12.5 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.138 -1.392 . . . . 0.53 109.168 177.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.958 HG22 HG22 ' A' ' 93' ' ' VAL . 5.7 m 96.48 -9.36 0.08 Allowed 'General case' 0 N--CA 1.468 0.468 0 O-C-N 124.077 0.861 . . . . 0.75 110.758 -178.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.493 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.9 OUTLIER -63.55 136.85 96.89 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-O 121.082 0.468 . . . . 0.86 111.834 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.995 ' HB3' ' HB2' ' A' ' 85' ' ' TYR . 32.0 Cg_exo -65.72 123.52 11.48 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.826 3.017 . . . . 0.99 113.07 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.459 ' O ' ' HB2' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -48.03 -36.53 13.05 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.144 -1.058 . . . . 2.72 108.144 178.413 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 82' ' ' GLN . 0.3 OUTLIER 164.27 -27.14 0.0 OUTLIER 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 114.44 -1.254 . . . . 3.31 111.631 178.1 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.569 ' O ' ' C ' ' A' ' 85' ' ' TYR . 2.8 p90 -105.8 -40.7 5.64 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.455 0.909 . . . . 3.73 113.455 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.995 ' HB2' ' HB3' ' A' ' 81' ' ' PRO . 1.2 m-30 12.52 -100.88 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 O-C-N 123.609 0.568 . . . . 4.34 110.69 -179.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.944 ' HG2' ' N ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -147.66 134.71 20.34 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.22 -1.4 . . . . 3.8 107.22 176.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -42.3 -42.95 3.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.175 0.512 . . . . 3.3 110.801 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.644 ' HG2' ' HG3' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -86.3 -20.92 27.68 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.533 -0.758 . . . . 3.63 111.137 179.405 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.969 ' HA ' ' HB ' ' A' ' 92' ' ' VAL . 2.5 mt-10 -68.73 -27.6 66.07 Favored 'General case' 0 CA--C 1.489 -1.386 0 CA-C-O 121.189 0.519 . . . . 2.22 109.734 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.967 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 3.8 m120 -52.84 -47.88 67.41 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 106.099 -1.815 . . . . 2.15 106.099 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.559 ' O ' ' HD3' ' A' ' 95' ' ' LYS . . . -89.42 -19.43 25.17 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.15 -1.386 . . . . 1.08 111.668 177.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.969 ' HB ' ' HA ' ' A' ' 89' ' ' GLU . 3.2 t -84.59 -51.96 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.631 0 CA-C-O 121.695 0.76 . . . . 0.99 109.208 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.958 HG22 HG22 ' A' ' 79' ' ' THR . 0.4 OUTLIER -54.15 -40.27 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.27 0 CA-C-N 114.798 -1.092 . . . . 0.88 108.937 178.408 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.546 ' HA ' ' NE2' ' A' ' 97' ' ' GLN . . . -61.76 -35.93 79.57 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 116.038 -0.528 . . . . 0.64 109.59 178.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.713 ' HG2' ' HA ' ' A' ' 92' ' ' VAL . 10.0 mmmt -49.84 -33.03 15.62 Favored 'General case' 0 C--N 1.343 0.306 0 N-CA-C 108.842 -0.799 . . . . 1.35 108.842 178.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.52 ' HB3' HG21 ' A' ' 79' ' ' THR . 1.8 t80 -69.22 -52.89 23.3 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.749 -0.659 . . . . 0.87 109.236 178.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.626 ' HG2' ' O ' ' A' ' 78' ' ' ALA . 48.8 mt-30 -45.63 -30.3 1.49 Allowed 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.916 0.865 . . . . 0.43 108.834 177.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.539 ' HB2' ' O ' ' A' ' 95' ' ' LYS . 3.6 mtmm -77.69 -54.78 5.97 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 114.525 -1.216 . . . . 1.6 109.818 178.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.617 ' O ' ' HB ' ' A' ' 103' ' ' ILE . 0.9 OUTLIER -50.51 -20.88 1.28 Allowed 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.384 -0.826 . . . . 1.92 109.971 179.06 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.735 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -74.57 -57.42 3.94 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.646 -0.706 . . . . 0.65 110.099 179.172 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.995 ' HB2' HG13 ' A' ' 71' ' ' ILE . 1.6 pt-20 -61.63 -36.98 82.32 Favored 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 119.744 -0.782 . . . . 2.72 111.809 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.677 ' O ' ' HA ' ' A' ' 106' ' ' ASN . 2.7 p -85.44 -34.21 8.43 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 CA-C-N 115.112 -0.949 . . . . 0.68 113.554 -177.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.617 ' HB ' ' O ' ' A' ' 99' ' ' LEU . 0.4 OUTLIER -98.96 -30.77 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 120.55 -0.46 . . . . 1.72 111.486 179.189 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.76 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 29.1 mmtt -85.69 -44.07 12.87 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.492 0.187 . . . . 1.71 110.971 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.851 ' OG ' HD11 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -86.66 -44.46 11.83 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.054 -1.091 . . . . 1.09 108.054 178.443 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.677 ' HA ' ' O ' ' A' ' 102' ' ' VAL . 1.9 m-80 74.07 -45.93 0.61 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.788 -1.551 . . . . 0.5 110.302 179.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 1.017 ' HB3' HD11 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -72.82 170.63 14.27 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 114.644 -1.162 . . . . 1.34 108.019 178.272 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.616 ' HB3' ' H ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -41.61 127.67 3.14 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 109.778 -0.452 . . . . 1.75 109.778 -178.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . 1.054 ' HB3' HG21 ' A' ' 71' ' ' ILE . 3.5 m120 -41.12 98.03 0.16 Allowed Pre-proline 0 C--N 1.317 -0.815 0 O-C-N 124.257 0.973 . . . . 0.41 110.689 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.906 ' HB2' HG12 ' A' ' 124' ' ' VAL . 74.1 Cg_exo -48.22 157.47 1.23 Allowed 'Trans proline' 0 CA--C 1.509 -0.728 0 C-N-CA 122.427 2.085 . . . . 0.38 112.126 -179.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.706 ' O ' ' HA ' ' A' ' 124' ' ' VAL . 0.0 OUTLIER -106.06 125.46 51.03 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.519 -0.764 . . . . 0.53 109.393 179.396 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.684 ' O ' HG23 ' A' ' 68' ' ' VAL . 2.6 t -79.33 145.04 9.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.538 0.209 . . . . 1.33 111.329 -178.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.685 ' O ' ' HA ' ' A' ' 122' ' ' VAL . 38.8 m-85 -135.88 117.35 14.77 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 122.339 0.256 . . . . 0.26 110.739 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.946 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 5.3 mtp85 -113.19 117.47 32.0 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 120.528 -0.469 . . . . 1.57 110.271 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.585 ' HB3' ' CB ' ' A' ' 64' ' ' ALA . 0.0 OUTLIER -138.54 113.17 8.97 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 124.248 0.968 . . . . 0.97 109.979 177.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.625 ' HA3' ' HA ' ' A' ' 120' ' ' LEU . . . 159.34 143.42 3.66 Favored Glycine 0 CA--C 1.498 -1.002 0 C-N-CA 120.173 -1.013 . . . . 0.51 111.009 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.738 ' HA ' ' HA ' ' A' ' 143' ' ' THR . 0.9 OUTLIER -104.47 106.18 16.57 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.415 -0.514 . . . . 2.06 112.303 -178.508 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.56 ' O ' ' HA ' ' A' ' 141' ' ' VAL . 85.6 t 105.6 -51.04 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.982 1.313 . . . . 0.56 110.263 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.541 ' HG2' HG12 ' A' ' 118' ' ' VAL . 1.9 mt-10 -143.45 75.45 1.48 Allowed 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 108.806 -0.813 . . . . 1.69 108.806 179.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.625 ' HA ' ' HA3' ' A' ' 116' ' ' GLY . 4.7 pp -71.58 172.15 10.13 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.753 -1.112 . . . . 0.78 111.66 -178.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -113.75 125.84 54.56 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.059 -1.428 . . . . 1.42 109.04 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.796 ' HB ' ' O ' ' A' ' 138' ' ' THR . 1.4 t -98.32 135.81 31.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.016 0.436 . . . . 0.99 111.457 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' TYR . . . . . 0.561 ' O ' ' HA ' ' A' ' 112' ' ' VAL . 20.5 m-85 -124.01 138.64 54.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.482 -0.781 . . . . 1.15 109.893 178.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.906 HG12 ' HB2' ' A' ' 110' ' ' PRO . 0.2 OUTLIER -135.79 118.79 22.78 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 N-CA-C 108.876 -0.787 . . . . 0.26 108.876 178.925 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 1.057 HG21 ' HB2' ' A' ' 42' ' ' TRP . 0.2 OUTLIER -140.95 128.67 22.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.603 0.716 . . . . 0.49 111.458 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.451 ' HA3' ' O ' ' A' ' 108' ' ' LYS . . . -99.82 -164.2 29.06 Favored Glycine 0 N--CA 1.43 -1.724 0 CA-C-N 114.635 -1.166 . . . . 0.23 110.392 178.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.712 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 1.7 pt-20 -145.73 94.39 2.48 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 114.249 1.203 . . . . 1.03 114.249 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . 1.045 ' H ' ' HD3' ' A' ' 129' ' ' PRO . 0.0 OUTLIER -170.46 27.56 0.01 OUTLIER Pre-proline 0 C--N 1.312 -1.062 0 CA-C-N 114.612 -1.176 . . . . 1.27 112.396 174.128 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 1.138 ' HB3' ' HA ' ' A' ' 12' ' ' THR . 6.3 Cg_exo -82.1 -48.77 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.021 0 N-CA-C 107.478 -1.778 . . . . 0.69 107.478 176.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.589 ' H ' ' HD2' ' A' ' 129' ' ' PRO . . . -125.88 -5.13 6.9 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 111.939 -2.391 . . . . 0.67 105.839 174.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.482 ' H ' ' HD2' ' A' ' 129' ' ' PRO . . . 124.78 12.47 4.05 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 113.543 -1.662 . . . . 0.83 109.793 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.995 ' H ' ' HD2' ' A' ' 129' ' ' PRO . 0.5 OUTLIER 158.96 108.76 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.663 0 CA-C-O 118.139 -0.934 . . . . 1.56 110.379 -178.59 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.889 HD23 HD11 ' A' ' 41' ' ' LEU . 1.0 OUTLIER 153.03 44.35 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 118.174 -0.917 . . . . 3.31 113.186 178.309 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.477 ' HB1' HG21 ' A' ' 16' ' ' ILE . . . -177.64 136.18 0.19 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 120.753 1.615 . . . . 0.46 114.241 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.786 ' HA3' ' HA ' ' A' ' 125' ' ' ILE . . . -165.44 -140.5 2.89 Favored Glycine 0 C--O 1.213 -1.21 0 CA-C-O 119.463 -0.632 . . . . 0.29 111.792 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.886 ' HA ' ' HA ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -138.34 -172.98 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 117.614 0.707 . . . . 0.52 110.516 179.17 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . 0.601 ' HA ' HG23 ' A' ' 124' ' ' VAL . 65.7 p -171.33 152.06 3.24 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.145 0.794 . . . . 1.2 113.145 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.796 ' O ' ' HB ' ' A' ' 122' ' ' VAL . 14.9 t -148.39 165.03 32.33 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.282 -0.417 . . . . 0.73 111.724 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.913 ' HG3' ' HB2' ' A' ' 31' ' ' SER . 0.1 OUTLIER -94.84 161.71 14.05 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.473 -0.936 . . . . 1.5 108.473 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 1.05 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 1.1 t -160.6 129.04 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 114.425 1.268 . . . . 0.73 114.425 -178.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.676 ' HB ' ' HB3' ' A' ' 32' ' ' GLU . 7.7 p -75.45 92.07 0.82 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.093 0 N-CA-C 108.889 -0.782 . . . . 1.56 108.889 175.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.565 ' HB3' ' CE1' ' A' ' 66' ' ' PHE . 25.5 mm-40 -152.94 149.87 28.68 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.571 -0.452 . . . . 2.32 111.22 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . 0.738 ' HA ' ' HA ' ' A' ' 117' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.328 -0.844 . . . . 3.3 111.105 179.812 . . . . . . . . 2 2 . 1 stop_ save_