data_2pnb_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 2pnb _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 121.462 0.648 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -76.8 -19.18 57.86 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.743 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.435 ' O ' ' O ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -170.09 -24.0 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.62 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' A' ' 19' ' ' ASP . . . 53.03 170.78 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.711 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -108.36 -63.17 1.36 Allowed 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.72 -0.792 . . . . 0.0 110.429 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -45.02 -36.32 3.4 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.218 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -90.42 134.39 34.38 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.717 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.507 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 16.9 m0 -89.25 -33.69 16.88 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 118.892 -1.123 . . . . 0.0 110.59 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.449 ' O ' ' OD2' ' A' ' 26' ' ' ASP . . . 139.68 35.44 0.13 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.449 ' OD2' ' O ' ' A' ' 25' ' ' GLY . 0.0 OUTLIER 68.77 119.92 0.03 OUTLIER 'General case' 0 C--N 1.295 -1.792 0 C-N-CA 120.054 -0.659 . . . . 0.0 111.024 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.56 -130.52 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.49 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.6 p -149.07 175.66 11.14 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 119.35 -0.94 . . . . 0.0 110.725 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -58.8 -30.39 67.58 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.431 -0.908 . . . . 0.0 110.608 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.401 ' O ' ' CG ' ' A' ' 34' ' ' GLU . 50.4 mt-10 -58.47 -55.79 30.45 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.275 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.401 ' O ' ' C ' ' A' ' 32' ' ' VAL . 2.6 mm-40 -68.32 -60.52 2.39 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.321 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.401 ' C ' ' O ' ' A' ' 31' ' ' GLU . 7.3 t -42.51 -66.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.26 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.515 ' O ' ' N ' ' A' ' 35' ' ' LYS . 36.4 t-20 -50.48 -65.99 0.46 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.768 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.409 ' C ' ' O ' ' A' ' 33' ' ' ASN . 31.0 mt-10 -36.32 -27.73 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.106 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 33' ' ' ASN . 2.4 tmtm? -95.2 -35.17 11.96 Favored 'General case' 0 C--N 1.293 -1.87 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.934 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' A' ' 33' ' ' ASN . 8.5 mp -88.86 3.66 50.47 Favored 'General case' 0 C--N 1.288 -2.102 0 C-N-CA 119.553 -0.859 . . . . 0.0 111.225 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -79.36 -12.62 59.92 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.584 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -151.18 76.1 1.21 Allowed 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.737 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.41 ' O ' ' O ' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -145.64 -172.84 3.98 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.877 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.41 ' O ' ' O ' ' A' ' 39' ' ' THR . . . -54.27 -169.16 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.054 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -104.94 58.96 0.69 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.841 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 154.7 68.19 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 C-N-CA 119.394 -1.384 . . . . 0.0 110.33 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -100.72 171.36 7.74 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.594 -0.843 . . . . 0.0 110.634 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.543 ' CE1' ' O ' ' A' ' 113' ' ' LEU . 9.7 p90 -166.69 128.03 1.7 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 118.298 -1.361 . . . . 0.0 113.482 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.58 -162.47 1.49 Allowed 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 114.548 -1.206 . . . . 0.0 109.031 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.2 t -115.15 154.42 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 C-N-CA 119.377 -0.929 . . . . 0.0 111.889 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.15 126.0 44.58 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.508 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -59.8 128.58 37.63 Favored 'General case' 0 C--N 1.29 -2.011 0 C-N-CA 119.079 -1.049 . . . . 0.0 112.313 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -103.98 67.24 0.86 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.749 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.4 p -84.73 25.66 0.89 Allowed 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.764 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.7 t -107.83 38.93 2.05 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.873 -0.731 . . . . 0.0 111.159 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.417 ' C ' ' N ' ' A' ' 54' ' ' HIS . 6.4 tttp -172.58 -19.49 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 119.03 -1.068 . . . . 0.0 111.213 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 31.2 mtt 49.69 17.78 0.28 Allowed 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.145 -1.022 . . . . 0.0 110.782 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.417 ' N ' ' C ' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -137.87 -14.51 1.4 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.791 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -103.52 170.76 19.63 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.529 ' O ' ' CD1' ' A' ' 57' ' ' TYR . 1.6 m-20 -85.87 -90.02 0.11 Allowed 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.762 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.529 ' CD1' ' O ' ' A' ' 56' ' ' ASP . 21.8 m-85 -138.53 -151.94 0.4 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.517 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -150.17 121.94 8.1 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.68 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mp -75.28 133.03 41.42 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.259 -0.977 . . . . 0.0 111.065 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -132.7 133.36 43.42 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.748 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.548 ' CD2' ' N ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -130.71 149.87 52.15 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.538 -0.865 . . . . 0.0 111.969 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.489 ' NE ' ' O ' ' A' ' 36' ' ' LEU . 11.3 tpt180 -90.3 114.95 27.11 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.441 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -92.0 45.16 1.2 Allowed 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 120.024 -0.67 . . . . 0.0 111.516 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.27 -15.09 63.98 Favored Glycine 0 N--CA 1.492 2.427 0 C-N-CA 119.332 -1.413 . . . . 0.0 110.628 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 167.5 -21.86 0.1 Allowed Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.421 -1.371 . . . . 0.0 110.271 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -103.26 105.31 15.57 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.871 -0.732 . . . . 0.0 110.558 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.479 ' OD1' ' N ' ' A' ' 67' ' ' ASN . 1.1 p30 -62.94 110.61 1.84 Allowed 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.623 -0.831 . . . . 0.0 111.013 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.3 tttp -88.82 121.33 31.08 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 119.29 -0.964 . . . . 0.0 110.111 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tp -89.73 140.61 29.41 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.233 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.7 mt -136.83 130.68 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.352 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -85.47 150.35 24.76 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 119.272 -0.971 . . . . 0.0 112.877 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.1 mm -102.97 128.99 55.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.557 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.651 ' CD1' ' N ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -95.11 97.59 10.04 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 118.498 -1.281 . . . . 0.0 111.168 -179.913 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.644 ' CG ' ' N ' ' A' ' 75' ' ' ARG . 0.6 OUTLIER -109.33 168.06 9.67 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.539 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.644 ' N ' ' CG ' ' A' ' 74' ' ' HIS . 0.4 OUTLIER -133.0 -67.88 0.61 Allowed 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.606 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -120.49 -23.24 6.17 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.976 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.423 ' N ' ' NE2' ' A' ' 74' ' ' HIS . . . 173.89 -7.54 0.03 OUTLIER Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.2 -163.97 1.09 Allowed 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.206 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.514 ' CZ ' ' OD2' ' A' ' 56' ' ' ASP . 51.2 m-85 -140.85 151.48 44.36 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 118.985 -1.086 . . . . 0.0 112.106 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.562 ' O ' ' CD2' ' A' ' 73' ' ' PHE . . . -125.99 118.68 3.22 Favored Glycine 0 N--CA 1.482 1.755 0 N-CA-C 109.309 -1.516 . . . . 0.0 109.309 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.518 ' CE2' ' OH ' ' A' ' 105' ' ' TYR . 0.2 OUTLIER -148.06 -29.06 0.32 Allowed 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.878 -179.961 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.528 ' OG ' ' N ' ' A' ' 83' ' ' ASP . 1.0 OUTLIER -146.23 -49.28 0.21 Allowed 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.065 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.528 ' N ' ' OG ' ' A' ' 82' ' ' SER . 0.2 OUTLIER -88.82 169.96 12.11 Favored Pre-proline 0 C--N 1.293 -1.873 0 C-N-CA 119.476 -0.889 . . . . 0.0 110.13 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -69.4 50.44 0.72 Allowed 'Trans proline' 0 CA--C 1.552 1.39 0 C-N-CA 121.259 1.306 . . . . 0.0 111.846 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.4 mt 51.97 82.92 0.06 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 119.509 -0.877 . . . . 0.0 110.734 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.37 -33.12 0.2 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.276 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.488 ' O ' ' ND2' ' A' ' 88' ' ' ASN . 2.4 p90 -63.08 -21.65 66.32 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 118.725 -1.19 . . . . 0.0 109.656 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 87' ' ' PHE . 9.4 p30 45.71 20.68 0.07 Allowed 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 114.379 1.252 . . . . 0.0 114.379 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.459 ' OG ' ' O ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -148.78 134.09 18.43 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 118.514 -1.274 . . . . 0.0 111.669 179.713 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.92 -42.6 17.34 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.822 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.054 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.9 t -53.75 -35.07 26.04 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 C-N-CA 119.11 -1.036 . . . . 0.0 109.259 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -70.25 -47.53 60.95 Favored 'General case' 0 C--N 1.296 -1.734 0 C-N-CA 119.48 -0.888 . . . . 0.0 108.998 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.414 ' O ' ' C ' ' A' ' 94' ' ' ILE . 0.8 OUTLIER -67.36 -71.5 0.2 Allowed 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.934 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.414 ' C ' ' O ' ' A' ' 93' ' ' LEU . 0.2 OUTLIER -39.73 -34.89 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.755 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -62.97 -47.54 82.73 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.887 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' A' ' 93' ' ' LEU . 0.2 OUTLIER -60.98 -22.97 65.0 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.09 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.531 ' OH ' ' NE2' ' A' ' 104' ' ' GLN . 14.7 m-85 -97.13 -26.79 14.84 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.251 -0.98 . . . . 0.0 111.388 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -61.89 -38.3 87.79 Favored 'General case' 0 C--N 1.299 -1.612 0 C-N-CA 118.992 -1.083 . . . . 0.0 110.236 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -85.99 -25.6 25.92 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 119.264 -0.975 . . . . 0.0 111.03 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.429 ' O ' ' OG ' ' A' ' 101' ' ' SER . 19.7 mt-10 -100.53 -105.43 0.23 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.479 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 100' ' ' GLU . 0.6 OUTLIER 172.6 136.98 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 119.364 -0.935 . . . . 0.0 110.65 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.88 83.63 0.93 Allowed 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 119.202 -0.999 . . . . 0.0 110.436 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -96.9 1.23 50.24 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.267 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.531 ' NE2' ' OH ' ' A' ' 97' ' ' TYR . 0.4 OUTLIER -90.3 -30.41 17.5 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.918 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.518 ' OH ' ' CE2' ' A' ' 81' ' ' PHE . 2.7 m-85 -56.35 -83.66 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.933 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.68 114.39 61.11 Favored Pre-proline 0 C--N 1.296 -1.73 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.601 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.608 ' C ' ' H ' ' A' ' 109' ' ' LEU . 1.3 Cg_endo -65.26 -171.99 0.21 Allowed 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 120.432 0.754 . . . . 0.0 111.673 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.409 ' NZ ' ' CB ' ' A' ' 108' ' ' LYS . 7.5 mtmp? 56.64 -13.04 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.788 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.608 ' H ' ' C ' ' A' ' 107' ' ' PRO . 0.9 OUTLIER -151.38 -159.72 1.06 Allowed 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 119.259 -0.977 . . . . 0.0 110.637 179.939 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.408 ' OD1' ' N ' ' A' ' 110' ' ' ASP . 0.2 OUTLIER -164.24 155.94 16.23 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.119 -1.032 . . . . 0.0 111.11 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.52 151.1 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 C-N-CA 119.929 -0.709 . . . . 0.0 110.881 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.0 112.8 11.51 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.787 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.543 ' O ' ' CE1' ' A' ' 44' ' ' PHE . 0.2 OUTLIER -97.84 66.33 1.89 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.271 -179.877 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.472 ' C ' ' CG ' ' A' ' 115' ' ' TYR . 0.9 OUTLIER -95.05 39.64 1.11 Allowed 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.686 -0.805 . . . . 0.0 111.115 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.489 ' N ' ' CD1' ' A' ' 115' ' ' TYR . 4.3 m-85 -148.73 71.12 10.52 Favored Pre-proline 0 C--N 1.302 -1.495 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.339 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -75.39 170.57 20.02 Favored 'Trans proline' 0 C--N 1.32 -0.923 0 C-N-CA 121.732 1.622 . . . . 0.0 111.549 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.88 145.46 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 119.709 -0.796 . . . . 0.0 109.757 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.4 t -172.39 -160.54 0.15 Allowed 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 118.884 -1.126 . . . . 0.0 111.285 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -127.87 8.16 6.23 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.27 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.307 -1.269 0 CA-C-O 116.336 -1.792 . . . . 0.0 110.932 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 17' ' ' LEU . 2.6 tt . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 121.462 0.648 . . . . 0.0 109.534 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -76.8 -19.18 57.86 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.743 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.435 ' O ' ' O ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -170.09 -24.0 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.62 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.715 ' HB1' ' CZ3' ' A' ' 22' ' ' TRP . . . 53.03 170.78 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.711 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -108.36 -63.17 1.36 Allowed 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.72 -0.792 . . . . 0.0 110.429 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.715 ' CZ3' ' HB1' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -45.02 -36.32 3.4 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.218 179.914 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.618 ' OH ' HD11 ' A' ' 59' ' ' LEU . 9.5 m-30 -90.42 134.39 34.38 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.717 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.507 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 16.9 m0 -89.25 -33.69 16.88 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 118.892 -1.123 . . . . 0.0 110.59 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.449 ' O ' ' OD2' ' A' ' 26' ' ' ASP . . . 139.68 35.44 0.13 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.449 ' OD2' ' O ' ' A' ' 25' ' ' GLY . 0.0 OUTLIER 68.77 119.92 0.03 OUTLIER 'General case' 0 C--N 1.295 -1.792 0 C-N-CA 120.054 -0.659 . . . . 0.0 111.024 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.56 -130.52 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.49 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.6 p -149.07 175.66 11.14 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 119.35 -0.94 . . . . 0.0 110.725 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -58.8 -30.39 67.58 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.431 -0.908 . . . . 0.0 110.608 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.401 ' O ' ' CG ' ' A' ' 34' ' ' GLU . 50.4 mt-10 -58.47 -55.79 30.45 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.275 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.401 ' O ' ' C ' ' A' ' 32' ' ' VAL . 2.6 mm-40 -68.32 -60.52 2.39 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.321 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.457 HG12 ' N ' ' A' ' 33' ' ' ASN . 7.3 t -42.51 -66.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.26 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.515 ' O ' ' N ' ' A' ' 35' ' ' LYS . 36.4 t-20 -50.48 -65.99 0.46 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.768 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.409 ' C ' ' O ' ' A' ' 33' ' ' ASN . 31.0 mt-10 -36.32 -27.73 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.106 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 33' ' ' ASN . 2.4 tmtm? -95.2 -35.17 11.96 Favored 'General case' 0 C--N 1.293 -1.87 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.934 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' A' ' 33' ' ' ASN . 8.5 mp -88.86 3.66 50.47 Favored 'General case' 0 C--N 1.288 -2.102 0 C-N-CA 119.553 -0.859 . . . . 0.0 111.225 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -79.36 -12.62 59.92 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.584 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -151.18 76.1 1.21 Allowed 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.737 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.41 ' O ' ' O ' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -145.64 -172.84 3.98 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.877 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.41 ' O ' ' O ' ' A' ' 39' ' ' THR . . . -54.27 -169.16 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.054 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -104.94 58.96 0.69 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.841 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 154.7 68.19 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 C-N-CA 119.394 -1.384 . . . . 0.0 110.33 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -100.72 171.36 7.74 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.594 -0.843 . . . . 0.0 110.634 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.543 ' CE1' ' O ' ' A' ' 113' ' ' LEU . 9.7 p90 -166.69 128.03 1.7 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 118.298 -1.361 . . . . 0.0 113.482 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.436 HD12 ' C ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -144.58 -162.47 1.49 Allowed 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 114.548 -1.206 . . . . 0.0 109.031 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.453 HG23 ' CE1' ' A' ' 23' ' ' TYR . 1.2 t -115.15 154.42 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 C-N-CA 119.377 -0.929 . . . . 0.0 111.889 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.15 126.0 44.58 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.508 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -59.8 128.58 37.63 Favored 'General case' 0 C--N 1.29 -2.011 0 C-N-CA 119.079 -1.049 . . . . 0.0 112.313 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -103.98 67.24 0.86 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.749 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.4 p -84.73 25.66 0.89 Allowed 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.764 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.7 t -107.83 38.93 2.05 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.873 -0.731 . . . . 0.0 111.159 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.417 ' C ' ' N ' ' A' ' 54' ' ' HIS . 6.4 tttp -172.58 -19.49 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 119.03 -1.068 . . . . 0.0 111.213 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 31.2 mtt 49.69 17.78 0.28 Allowed 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.145 -1.022 . . . . 0.0 110.782 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.417 ' N ' ' C ' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -137.87 -14.51 1.4 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.791 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -103.52 170.76 19.63 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.529 ' O ' ' CD1' ' A' ' 57' ' ' TYR . 1.6 m-20 -85.87 -90.02 0.11 Allowed 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.762 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.529 ' CD1' ' O ' ' A' ' 56' ' ' ASP . 21.8 m-85 -138.53 -151.94 0.4 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.517 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -150.17 121.94 8.1 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.68 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.618 HD11 ' OH ' ' A' ' 23' ' ' TYR . 2.6 mp -75.28 133.03 41.42 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.259 -0.977 . . . . 0.0 111.065 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.845 ' C ' HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -132.7 133.36 43.42 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.748 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.845 HD23 ' C ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -130.71 149.87 52.15 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.538 -0.865 . . . . 0.0 111.969 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.489 ' NE ' ' O ' ' A' ' 36' ' ' LEU . 11.3 tpt180 -90.3 114.95 27.11 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.441 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -92.0 45.16 1.2 Allowed 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 120.024 -0.67 . . . . 0.0 111.516 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.27 -15.09 63.98 Favored Glycine 0 N--CA 1.492 2.427 0 C-N-CA 119.332 -1.413 . . . . 0.0 110.628 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 167.5 -21.86 0.1 Allowed Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.421 -1.371 . . . . 0.0 110.271 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -103.26 105.31 15.57 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.871 -0.732 . . . . 0.0 110.558 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.479 ' OD1' ' N ' ' A' ' 67' ' ' ASN . 1.1 p30 -62.94 110.61 1.84 Allowed 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.623 -0.831 . . . . 0.0 111.013 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.3 tttp -88.82 121.33 31.08 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 119.29 -0.964 . . . . 0.0 110.111 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.569 HD12 ' OG1' ' A' ' 60' ' ' THR . 1.3 tp -89.73 140.61 29.41 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.233 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.612 HD12 HD21 ' A' ' 61' ' ' LEU . 5.7 mt -136.83 130.68 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.352 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -85.47 150.35 24.76 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 119.272 -0.971 . . . . 0.0 112.877 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.1 mm -102.97 128.99 55.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.557 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.651 ' CD1' ' N ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -95.11 97.59 10.04 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 118.498 -1.281 . . . . 0.0 111.168 -179.913 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.644 ' CG ' ' N ' ' A' ' 75' ' ' ARG . 0.6 OUTLIER -109.33 168.06 9.67 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.539 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.644 ' N ' ' CG ' ' A' ' 74' ' ' HIS . 0.4 OUTLIER -133.0 -67.88 0.61 Allowed 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.606 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -120.49 -23.24 6.17 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.976 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.423 ' N ' ' NE2' ' A' ' 74' ' ' HIS . . . 173.89 -7.54 0.03 OUTLIER Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.2 -163.97 1.09 Allowed 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.206 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.514 ' CZ ' ' OD2' ' A' ' 56' ' ' ASP . 51.2 m-85 -140.85 151.48 44.36 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 118.985 -1.086 . . . . 0.0 112.106 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.562 ' O ' ' CD2' ' A' ' 73' ' ' PHE . . . -125.99 118.68 3.22 Favored Glycine 0 N--CA 1.482 1.755 0 N-CA-C 109.309 -1.516 . . . . 0.0 109.309 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.483 ' CE2' ' OH ' ' A' ' 105' ' ' TYR . 0.2 OUTLIER -148.06 -29.06 0.32 Allowed 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.878 -179.961 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.528 ' OG ' ' N ' ' A' ' 83' ' ' ASP . 1.0 OUTLIER -146.23 -49.28 0.21 Allowed 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.065 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.528 ' N ' ' OG ' ' A' ' 82' ' ' SER . 0.2 OUTLIER -88.82 169.96 12.11 Favored Pre-proline 0 C--N 1.293 -1.873 0 C-N-CA 119.476 -0.889 . . . . 0.0 110.13 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -69.4 50.44 0.72 Allowed 'Trans proline' 0 CA--C 1.552 1.39 0 C-N-CA 121.259 1.306 . . . . 0.0 111.846 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.4 mt 51.97 82.92 0.06 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 119.509 -0.877 . . . . 0.0 110.734 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.37 -33.12 0.2 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.276 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.455 ' O ' ' OG ' ' A' ' 89' ' ' SER . 2.4 p90 -63.08 -21.65 66.32 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 118.725 -1.19 . . . . 0.0 109.656 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.401 ' CG ' ' O ' ' A' ' 87' ' ' PHE . 1.6 p-10 45.71 20.68 0.07 Allowed 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 114.379 1.252 . . . . 0.0 114.379 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -148.78 134.09 18.43 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 118.514 -1.274 . . . . 0.0 111.669 179.713 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.42 ' H ' HG23 ' A' ' 90' ' ' VAL . 0.9 OUTLIER -83.92 -42.6 17.34 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.822 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.054 -179.831 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.486 ' H ' HG23 ' A' ' 91' ' ' VAL . 1.9 t -53.75 -35.07 26.04 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 C-N-CA 119.11 -1.036 . . . . 0.0 109.259 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -70.25 -47.53 60.95 Favored 'General case' 0 C--N 1.296 -1.734 0 C-N-CA 119.48 -0.888 . . . . 0.0 108.998 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.414 ' O ' ' C ' ' A' ' 94' ' ' ILE . 0.8 OUTLIER -67.36 -71.5 0.2 Allowed 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.934 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.451 ' HA ' HD13 ' A' ' 94' ' ' ILE . 0.2 OUTLIER -39.73 -34.89 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.755 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -62.97 -47.54 82.73 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.887 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' A' ' 93' ' ' LEU . 0.2 OUTLIER -60.98 -22.97 65.0 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.09 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.48 ' CD1' HD23 ' A' ' 102' ' ' LEU . 14.7 m-85 -97.13 -26.79 14.84 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.251 -0.98 . . . . 0.0 111.388 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -61.89 -38.3 87.79 Favored 'General case' 0 C--N 1.299 -1.612 0 C-N-CA 118.992 -1.083 . . . . 0.0 110.236 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -85.99 -25.6 25.92 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 119.264 -0.975 . . . . 0.0 111.03 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -100.53 -105.43 0.23 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.479 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 172.6 136.98 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 119.364 -0.935 . . . . 0.0 110.65 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.48 HD23 ' CD1' ' A' ' 97' ' ' TYR . 9.8 mt -71.88 83.63 0.93 Allowed 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 119.202 -0.999 . . . . 0.0 110.436 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -96.9 1.23 50.24 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.267 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -90.3 -30.41 17.5 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.918 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.483 ' OH ' ' CE2' ' A' ' 81' ' ' PHE . 2.7 m-85 -56.35 -83.66 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.933 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.68 114.39 61.11 Favored Pre-proline 0 C--N 1.296 -1.73 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.601 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.599 ' C ' ' H ' ' A' ' 109' ' ' LEU . 1.3 Cg_endo -65.26 -171.99 0.21 Allowed 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 120.432 0.754 . . . . 0.0 111.673 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.409 ' NZ ' ' CB ' ' A' ' 108' ' ' LYS . 7.5 mtmp? 56.64 -13.04 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.788 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.599 ' H ' ' C ' ' A' ' 107' ' ' PRO . 0.9 OUTLIER -151.38 -159.72 1.06 Allowed 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 119.259 -0.977 . . . . 0.0 110.637 179.939 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.408 ' OD1' ' N ' ' A' ' 110' ' ' ASP . 0.2 OUTLIER -164.24 155.94 16.23 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.119 -1.032 . . . . 0.0 111.11 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.52 151.1 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 C-N-CA 119.929 -0.709 . . . . 0.0 110.881 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.0 112.8 11.51 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.787 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.606 ' H ' ' CD2' ' A' ' 113' ' ' LEU . 0.2 OUTLIER -97.84 66.33 1.89 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.271 -179.877 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.472 ' C ' ' CG ' ' A' ' 115' ' ' TYR . 0.9 OUTLIER -95.05 39.64 1.11 Allowed 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.686 -0.805 . . . . 0.0 111.115 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.489 ' CD1' ' N ' ' A' ' 115' ' ' TYR . 4.3 m-85 -148.73 71.12 10.52 Favored Pre-proline 0 C--N 1.302 -1.495 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.339 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -75.39 170.57 20.02 Favored 'Trans proline' 0 C--N 1.32 -0.923 0 C-N-CA 121.732 1.622 . . . . 0.0 111.549 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.88 145.46 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 119.709 -0.796 . . . . 0.0 109.757 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.4 t -172.39 -160.54 0.15 Allowed 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 118.884 -1.126 . . . . 0.0 111.285 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -127.87 8.16 6.23 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.27 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.307 -1.269 0 CA-C-O 116.336 -1.792 . . . . 0.0 110.932 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 17' ' ' LEU . 2.6 tt . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 121.462 0.648 . . . . 0.0 109.534 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -76.8 -19.18 57.86 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.743 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.435 ' O ' ' O ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -170.09 -24.0 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.62 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.715 ' HB1' ' CZ3' ' A' ' 22' ' ' TRP . . . 53.03 170.78 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.711 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -108.36 -63.17 1.36 Allowed 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.72 -0.792 . . . . 0.0 110.429 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.715 ' CZ3' ' HB1' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -45.02 -36.32 3.4 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.218 179.914 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.618 ' OH ' HD11 ' A' ' 59' ' ' LEU . 9.5 m-30 -90.42 134.39 34.38 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.717 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.507 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 16.9 m0 -89.25 -33.69 16.88 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 118.892 -1.123 . . . . 0.0 110.59 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.449 ' O ' ' OD2' ' A' ' 26' ' ' ASP . . . 139.68 35.44 0.13 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.449 ' OD2' ' O ' ' A' ' 25' ' ' GLY . 0.0 OUTLIER 68.77 119.92 0.03 OUTLIER 'General case' 0 C--N 1.295 -1.792 0 C-N-CA 120.054 -0.659 . . . . 0.0 111.024 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.56 -130.52 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.49 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.6 p -149.07 175.66 11.14 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 119.35 -0.94 . . . . 0.0 110.725 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -58.8 -30.39 67.58 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.431 -0.908 . . . . 0.0 110.608 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.401 ' O ' ' CG ' ' A' ' 34' ' ' GLU . 50.4 mt-10 -58.47 -55.79 30.45 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.275 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.401 ' O ' ' C ' ' A' ' 32' ' ' VAL . 2.6 mm-40 -68.32 -60.52 2.39 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.321 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.457 HG12 ' N ' ' A' ' 33' ' ' ASN . 7.3 t -42.51 -66.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.26 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.515 ' O ' ' N ' ' A' ' 35' ' ' LYS . 36.4 t-20 -50.48 -65.99 0.46 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.768 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.409 ' C ' ' O ' ' A' ' 33' ' ' ASN . 31.0 mt-10 -36.32 -27.73 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.106 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 33' ' ' ASN . 2.4 tmtm? -95.2 -35.17 11.96 Favored 'General case' 0 C--N 1.293 -1.87 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.934 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' A' ' 33' ' ' ASN . 8.5 mp -88.86 3.66 50.47 Favored 'General case' 0 C--N 1.288 -2.102 0 C-N-CA 119.553 -0.859 . . . . 0.0 111.225 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -79.36 -12.62 59.92 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.584 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -151.18 76.1 1.21 Allowed 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.737 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.41 ' O ' ' O ' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -145.64 -172.84 3.98 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.877 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.41 ' O ' ' O ' ' A' ' 39' ' ' THR . . . -54.27 -169.16 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.054 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -104.94 58.96 0.69 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.841 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 154.7 68.19 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 C-N-CA 119.394 -1.384 . . . . 0.0 110.33 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -100.72 171.36 7.74 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.594 -0.843 . . . . 0.0 110.634 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.543 ' CE1' ' O ' ' A' ' 113' ' ' LEU . 9.7 p90 -166.69 128.03 1.7 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 118.298 -1.361 . . . . 0.0 113.482 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.436 HD12 ' C ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -144.58 -162.47 1.49 Allowed 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 114.548 -1.206 . . . . 0.0 109.031 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.453 HG23 ' CE1' ' A' ' 23' ' ' TYR . 1.2 t -115.15 154.42 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 C-N-CA 119.377 -0.929 . . . . 0.0 111.889 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.15 126.0 44.58 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.508 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -59.8 128.58 37.63 Favored 'General case' 0 C--N 1.29 -2.011 0 C-N-CA 119.079 -1.049 . . . . 0.0 112.313 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -103.98 67.24 0.86 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.749 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.4 p -84.73 25.66 0.89 Allowed 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.764 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.7 t -107.83 38.93 2.05 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.873 -0.731 . . . . 0.0 111.159 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.417 ' C ' ' N ' ' A' ' 54' ' ' HIS . 6.4 tttp -172.58 -19.49 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 119.03 -1.068 . . . . 0.0 111.213 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 31.2 mtt 49.69 17.78 0.28 Allowed 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.145 -1.022 . . . . 0.0 110.782 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.417 ' N ' ' C ' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -137.87 -14.51 1.4 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.791 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -103.52 170.76 19.63 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.529 ' O ' ' CD1' ' A' ' 57' ' ' TYR . 1.6 m-20 -85.87 -90.02 0.11 Allowed 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.762 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.529 ' CD1' ' O ' ' A' ' 56' ' ' ASP . 21.8 m-85 -138.53 -151.94 0.4 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.517 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -150.17 121.94 8.1 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.68 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.618 HD11 ' OH ' ' A' ' 23' ' ' TYR . 2.6 mp -75.28 133.03 41.42 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.259 -0.977 . . . . 0.0 111.065 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.845 ' C ' HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -132.7 133.36 43.42 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.748 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.845 HD23 ' C ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -130.71 149.87 52.15 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.538 -0.865 . . . . 0.0 111.969 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.489 ' NE ' ' O ' ' A' ' 36' ' ' LEU . 11.3 tpt180 -90.3 114.95 27.11 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.441 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -92.0 45.16 1.2 Allowed 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 120.024 -0.67 . . . . 0.0 111.516 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.27 -15.09 63.98 Favored Glycine 0 N--CA 1.492 2.427 0 C-N-CA 119.332 -1.413 . . . . 0.0 110.628 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 167.5 -21.86 0.1 Allowed Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.421 -1.371 . . . . 0.0 110.271 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -103.26 105.31 15.57 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.871 -0.732 . . . . 0.0 110.558 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.479 ' OD1' ' N ' ' A' ' 67' ' ' ASN . 1.1 p30 -62.94 110.61 1.84 Allowed 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.623 -0.831 . . . . 0.0 111.013 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.3 tttp -88.82 121.33 31.08 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 119.29 -0.964 . . . . 0.0 110.111 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.569 HD12 ' OG1' ' A' ' 60' ' ' THR . 1.3 tp -89.73 140.61 29.41 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.233 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.612 HD12 HD21 ' A' ' 61' ' ' LEU . 5.7 mt -136.83 130.68 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.352 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -85.47 150.35 24.76 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 119.272 -0.971 . . . . 0.0 112.877 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.1 mm -102.97 128.99 55.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.557 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.651 ' CD1' ' N ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -95.11 97.59 10.04 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 118.498 -1.281 . . . . 0.0 111.168 -179.913 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.644 ' CG ' ' N ' ' A' ' 75' ' ' ARG . 0.6 OUTLIER -109.33 168.06 9.67 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.539 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.644 ' N ' ' CG ' ' A' ' 74' ' ' HIS . 0.4 OUTLIER -133.0 -67.88 0.61 Allowed 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.606 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -120.49 -23.24 6.17 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.976 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.423 ' N ' ' NE2' ' A' ' 74' ' ' HIS . . . 173.89 -7.54 0.03 OUTLIER Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.2 -163.97 1.09 Allowed 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.206 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.514 ' CZ ' ' OD2' ' A' ' 56' ' ' ASP . 51.2 m-85 -140.85 151.48 44.36 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 118.985 -1.086 . . . . 0.0 112.106 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.562 ' O ' ' CD2' ' A' ' 73' ' ' PHE . . . -125.99 118.68 3.22 Favored Glycine 0 N--CA 1.482 1.755 0 N-CA-C 109.309 -1.516 . . . . 0.0 109.309 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.483 ' CE2' ' OH ' ' A' ' 105' ' ' TYR . 0.2 OUTLIER -148.06 -29.06 0.32 Allowed 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.878 -179.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.528 ' OG ' ' N ' ' A' ' 83' ' ' ASP . 1.0 OUTLIER -146.23 -49.28 0.21 Allowed 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.065 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.528 ' N ' ' OG ' ' A' ' 82' ' ' SER . 0.2 OUTLIER -88.82 169.96 12.11 Favored Pre-proline 0 C--N 1.293 -1.873 0 C-N-CA 119.476 -0.889 . . . . 0.0 110.13 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -69.4 50.44 0.72 Allowed 'Trans proline' 0 CA--C 1.552 1.39 0 C-N-CA 121.259 1.306 . . . . 0.0 111.846 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.4 mt 51.97 82.92 0.06 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 119.509 -0.877 . . . . 0.0 110.734 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.37 -33.12 0.2 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.276 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.488 ' O ' ' ND2' ' A' ' 88' ' ' ASN . 2.4 p90 -63.08 -21.65 66.32 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 118.725 -1.19 . . . . 0.0 109.656 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 87' ' ' PHE . 9.4 p30 45.71 20.68 0.07 Allowed 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 114.379 1.252 . . . . 0.0 114.379 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -148.78 134.09 18.43 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 118.514 -1.274 . . . . 0.0 111.669 179.713 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.42 ' H ' HG23 ' A' ' 90' ' ' VAL . 0.9 OUTLIER -83.92 -42.6 17.34 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.822 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.054 -179.831 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.486 ' H ' HG23 ' A' ' 91' ' ' VAL . 1.9 t -53.75 -35.07 26.04 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 C-N-CA 119.11 -1.036 . . . . 0.0 109.259 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -70.25 -47.53 60.95 Favored 'General case' 0 C--N 1.296 -1.734 0 C-N-CA 119.48 -0.888 . . . . 0.0 108.998 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.414 ' O ' ' C ' ' A' ' 94' ' ' ILE . 0.8 OUTLIER -67.36 -71.5 0.2 Allowed 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.934 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.451 ' HA ' HD13 ' A' ' 94' ' ' ILE . 0.2 OUTLIER -39.73 -34.89 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.755 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -62.97 -47.54 82.73 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.887 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' A' ' 93' ' ' LEU . 0.2 OUTLIER -60.98 -22.97 65.0 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.09 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.531 ' OH ' ' NE2' ' A' ' 104' ' ' GLN . 14.7 m-85 -97.13 -26.79 14.84 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.251 -0.98 . . . . 0.0 111.388 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -61.89 -38.3 87.79 Favored 'General case' 0 C--N 1.299 -1.612 0 C-N-CA 118.992 -1.083 . . . . 0.0 110.236 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -85.99 -25.6 25.92 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 119.264 -0.975 . . . . 0.0 111.03 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -100.53 -105.43 0.23 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.479 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 172.6 136.98 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 119.364 -0.935 . . . . 0.0 110.65 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.48 HD23 ' CD1' ' A' ' 97' ' ' TYR . 9.8 mt -71.88 83.63 0.93 Allowed 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 119.202 -0.999 . . . . 0.0 110.436 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -96.9 1.23 50.24 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.267 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.531 ' NE2' ' OH ' ' A' ' 97' ' ' TYR . 0.4 OUTLIER -90.3 -30.41 17.5 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.918 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.483 ' OH ' ' CE2' ' A' ' 81' ' ' PHE . 2.7 m-85 -56.35 -83.66 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.933 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.68 114.39 61.11 Favored Pre-proline 0 C--N 1.296 -1.73 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.601 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.599 ' C ' ' H ' ' A' ' 109' ' ' LEU . 1.3 Cg_endo -65.26 -171.99 0.21 Allowed 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 120.432 0.754 . . . . 0.0 111.673 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.409 ' NZ ' ' CB ' ' A' ' 108' ' ' LYS . 7.5 mtmp? 56.64 -13.04 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.788 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.599 ' H ' ' C ' ' A' ' 107' ' ' PRO . 0.9 OUTLIER -151.38 -159.72 1.06 Allowed 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 119.259 -0.977 . . . . 0.0 110.637 179.939 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.408 ' OD1' ' N ' ' A' ' 110' ' ' ASP . 0.2 OUTLIER -164.24 155.94 16.23 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.119 -1.032 . . . . 0.0 111.11 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.52 151.1 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 C-N-CA 119.929 -0.709 . . . . 0.0 110.881 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.0 112.8 11.51 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.787 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.606 ' H ' ' CD2' ' A' ' 113' ' ' LEU . 0.2 OUTLIER -97.84 66.33 1.89 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.271 -179.877 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.472 ' C ' ' CG ' ' A' ' 115' ' ' TYR . 0.9 OUTLIER -95.05 39.64 1.11 Allowed 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.686 -0.805 . . . . 0.0 111.115 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.489 ' CD1' ' N ' ' A' ' 115' ' ' TYR . 4.3 m-85 -148.73 71.12 10.52 Favored Pre-proline 0 C--N 1.302 -1.495 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.339 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -75.39 170.57 20.02 Favored 'Trans proline' 0 C--N 1.32 -0.923 0 C-N-CA 121.732 1.622 . . . . 0.0 111.549 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.88 145.46 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 119.709 -0.796 . . . . 0.0 109.757 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.4 t -172.39 -160.54 0.15 Allowed 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 118.884 -1.126 . . . . 0.0 111.285 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -127.87 8.16 6.23 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.27 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.307 -1.269 0 CA-C-O 116.336 -1.792 . . . . 0.0 110.932 -179.967 . . . . . . . . 1 1 . 1 stop_ save_