data_1haa_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 1haa _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' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.881 0.372 . . . . 1.72 111.027 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 56.4 t -125.43 131.57 72.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.071 -0.513 . . . . 1.25 110.816 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.0 m -125.97 167.43 15.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.059 -0.518 . . . . 0.35999999999999999 110.956 179.954 -59.999 -78.044 -69.422 103.854 2.031 104.092 -62.147 -40.825 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.438 ' NE2' ' HA ' ' A' ' 64' ' ' LYS . 78.8 m-70 -94.68 136.65 34.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.847 -0.615 . . . . 0.53000000000000003 110.696 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.484 ' HA ' ' HB3' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -122.26 154.86 37.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.263 0.554 . . . . 1.1299999999999999 111.237 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.435 HG23 ' CD1' ' B' ' 77' ' ' TYR . 2.2 p -131.09 19.15 4.95 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.206 -0.906 . . . . 1.1899999999999999 110.909 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -80.31 -35.3 35.93 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.829 0.347 . . . . 1.29 111.583 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.439 ' OG1' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -69.83 -168.5 0.2 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.162 -0.472 . . . . 1.26 109.781 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.558 ' CB ' ' HD3' ' A' ' 10' ' ' PRO . 0.3 OUTLIER -69.24 -68.34 0.59 Allowed Pre-proline 0 N--CA 1.456 -0.168 0 N-CA-C 107.62 -1.252 . . . . 1.54 107.62 178.234 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.558 ' HD3' ' CB ' ' A' ' 9' ' ' SER . 93.5 Cg_endo -87.35 169.57 7.12 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 122.09 1.86 . . . . 0.98999999999999999 109.636 176.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.504 ' CG2' ' CZ ' ' B' ' 77' ' ' TYR . 29.5 pt -90.37 131.62 37.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 C-N-CA 120.446 -0.502 . . . . 2.1600000000000001 111.208 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -143.2 -175.13 4.41 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.911 -0.586 . . . . 1.1200000000000001 110.676 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -138.69 133.88 32.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.308 -0.406 . . . . 1.1299999999999999 111.068 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 2' ' ' VAL . 1.1 p -124.2 -174.22 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.102 -0.499 . . . . 1.6699999999999999 110.998 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.427 ' H ' ' CG2' ' A' ' 14' ' ' VAL . 3.5 m -106.07 111.74 24.5 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.744 -0.662 . . . . 1.5700000000000001 109.987 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 m -56.95 133.46 79.85 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.257 -0.429 . . . . 0.87 110.767 -179.742 -34.01 -149.523 100.267 104.154 2.029 103.941 150.793 -161.675 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.488 ' O ' ' N ' ' A' ' 19' ' ' GLY . 30.1 Cg_endo -63.78 175.48 2.95 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.527 2.151 . . . . 1.8500000000000001 111.729 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HD2' ' HB2' ' A' ' 17' ' ' PRO . 20.3 Cg_endo -60.86 68.95 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.353 2.035 . . . . 3.0299999999999998 111.903 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 17' ' ' PRO . . . -164.61 -41.09 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.837 -0.62 . . . . 1.71 112.342 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -114.85 136.67 52.83 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.254 0.549 . . . . 2.2999999999999998 110.803 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -123.18 -18.83 6.2 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.389 -0.823 . . . . 1.28 110.948 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.407 ' CD2' ' CB ' ' A' ' 61' ' ' SER . 7.6 mt -105.58 161.43 14.37 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 116.291 -0.413 . . . . 1.79 111.306 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 59' ' ' CYS . 4.3 m -112.55 169.4 8.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.862 -0.608 . . . . 0.45000000000000001 109.912 179.314 -40.825 -62.147 -69.422 104.092 2.031 103.854 -78.044 -59.999 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.468 ' CE2' ' HA2' ' A' ' 43' ' ' GLY . 1.1 p90 -145.24 146.36 31.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.302 0.572 . . . . 1.45 112.013 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -135.24 109.85 8.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.039 -0.982 . . . . 3.1000000000000001 109.543 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.473 ' HB3' ' CB ' ' A' ' 41' ' ' GLU . 6.8 tttp -89.88 146.52 24.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.94 0.4 . . . . 2.7799999999999998 111.431 -179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.567 ' HA ' ' O ' ' A' ' 39' ' ' VAL . 0.2 OUTLIER -147.55 132.63 18.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.893 -0.594 . . . . 2.3500000000000001 111.667 179.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.554 ' C ' ' HA ' ' A' ' 38' ' ' LYS . 0.5 OUTLIER -170.58 121.22 0.59 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.421 -0.809 . . . . 1.8799999999999999 109.788 179.167 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.764 ' HA ' ' C ' ' A' ' 37' ' ' GLY . 79.0 m -54.97 113.21 1.26 Allowed 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 113.901 1.075 . . . . 0.73999999999999999 113.901 -176.902 -63.867 -162.406 23.528 105.439 2.043 106.329 73.536 -159.079 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.927 ' O ' ' N ' ' A' ' 32' ' ' PHE . 1.9 p30 -73.58 145.37 45.52 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 105.008 -2.219 . . . . 1.5600000000000001 105.008 174.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.434 ' O ' ' HD1' ' A' ' 32' ' ' PHE . . . -36.15 56.57 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.941 1.089 . . . . 1.8 113.941 -175.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.927 ' N ' ' O ' ' A' ' 30' ' ' ASP . 0.1 OUTLIER -172.92 29.12 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.261 -0.882 . . . . 2.73 110.345 177.582 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.691 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 5.7 t -41.2 -24.93 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 111.599 0.222 . . . . 1.0800000000000001 111.599 -179.716 -159.079 73.536 23.528 106.329 2.043 105.439 -162.406 -63.867 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -77.23 -48.72 16.8 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.897 0.38 . . . . 2.3500000000000001 110.011 178.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.446 ' HB2' ' CD2' ' A' ' 32' ' ' PHE . 0.8 OUTLIER -97.1 -79.66 0.45 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.079 -0.509 . . . . 1.99 110.016 179.128 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.579 ' H ' ' HB3' ' A' ' 32' ' ' PHE . 4.7 mmt85 -69.06 -82.54 0.03 OUTLIER 'General case' 0 C--O 1.232 0.166 0 N-CA-C 108.271 -1.011 . . . . 3.7599999999999998 108.271 178.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.764 ' C ' ' HA ' ' A' ' 29' ' ' CYS . . . 84.15 -146.84 23.14 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 119.007 -1.568 . . . . 0.95999999999999996 115.611 176.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.753 ' N ' ' HA ' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -39.56 107.03 0.06 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 113.572 0.953 . . . . 2.6800000000000002 113.572 -175.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.567 ' O ' ' HA ' ' A' ' 27' ' ' MET . 2.2 t -71.03 134.13 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 107.69 -1.226 . . . . 1.46 107.69 177.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.459 ' CG1' ' CD2' ' A' ' 68' ' ' HIS . 6.4 t -105.31 121.46 57.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.153 0.502 . . . . 1.26 111.921 -178.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.473 ' CB ' ' HB3' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -114.7 155.03 27.38 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.324 -0.853 . . . . 2.0 109.545 178.806 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.484 ' HB3' ' HA ' ' A' ' 5' ' ' THR . 0.8 OUTLIER -141.66 139.3 32.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.815 0.34 . . . . 1.8 111.376 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.468 ' HA2' ' CE2' ' A' ' 24' ' ' TYR . . . 177.23 166.32 33.89 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.525 -0.845 . . . . 0.63 112.812 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 7.8 t -95.13 162.09 13.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.751 0.31 . . . . 1.27 110.791 179.985 -161.675 150.793 100.267 103.941 2.029 104.154 -149.523 -34.01 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -162.02 151.57 16.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.349 -0.387 . . . . 1.52 111.143 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.96 -37.94 38.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 1.45 111.108 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.34 176.44 8.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 2.27 110.928 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.3 t -102.9 92.8 3.83 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 2.0899999999999999 110.878 179.817 -158.309 51.505 69.576 103.97 2.03 103.845 108.872 -20.545 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -68.05 -179.38 2.14 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.568 2.179 . . . . 2.6400000000000001 112.402 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.6 m -58.95 -174.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 3.8999999999999999 110.98 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -169.76 135.66 1.5 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 6.5700000000000003 111.13 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.1 mttm -81.23 152.63 71.09 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 5.8600000000000003 110.896 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -48.13 -30.52 14.57 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.642 2.228 . . . . 4.4500000000000002 112.432 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -91.88 -75.71 0.47 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 6.1299999999999999 111.025 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.445 ' CG ' ' CE3' ' A' ' 28' ' ' TRP . 30.0 mt-10 -73.29 83.52 1.39 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.122 -0.49 . . . . 3.3300000000000001 110.718 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -100.68 153.8 19.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 4.0 111.049 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.459 ' CG1' ' HB2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -135.94 124.09 36.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.89 -0.596 . . . . 2.0899999999999999 110.808 179.937 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.8 p -93.32 115.62 28.19 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.961 0.41 . . . . 1.8799999999999999 110.637 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -101.33 138.33 38.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.978 -0.555 . . . . 1.3899999999999999 110.689 -179.745 -20.545 108.872 69.576 103.845 2.03 103.97 51.505 -158.309 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.1 p -130.46 162.86 28.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.443 -0.344 . . . . 1.24 110.879 179.946 35.261 100.852 80.899 103.709 2.028 103.782 94.754 69.861 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.407 ' CB ' ' CD2' ' A' ' 22' ' ' LEU . 25.7 p -114.92 55.63 0.75 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.326 -0.397 . . . . 1.3999999999999999 111.338 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.6 m -153.84 163.02 40.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.362 -0.381 . . . . 2.2400000000000002 110.78 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -71.58 151.85 43.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.513 -0.312 . . . . 1.6699999999999999 110.506 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.438 ' HA ' ' NE2' ' A' ' 4' ' ' HIS . 3.5 ptmt 34.9 41.43 0.06 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.018 -0.537 . . . . 3.2999999999999998 111.032 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.511 ' C ' ' HD3' ' A' ' 67' ' ' PRO . 20.2 p -90.92 -12.28 36.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.727 -0.67 . . . . 1.0800000000000001 112.656 -178.598 69.861 94.754 80.899 103.782 2.028 103.709 100.852 35.261 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.444 ' ND2' ' HG ' ' A' ' 42' ' ' LEU . 17.3 p-10 -113.23 57.89 0.65 Allowed Pre-proline 0 N--CA 1.453 -0.322 0 N-CA-C 112.513 0.56 . . . . 0.60999999999999999 112.513 -178.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.511 ' HD3' ' C ' ' A' ' 65' ' ' CYS . 69.0 Cg_endo -84.29 160.07 13.1 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.676 2.25 . . . . 0.65000000000000002 112.07 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.459 ' CD2' ' CG1' ' A' ' 40' ' ' VAL . 9.9 t-80 -57.4 134.26 81.63 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.401 -0.363 . . . . 0.57999999999999996 110.594 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -55.45 -26.56 54.4 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.203 1.935 . . . . 1.1599999999999999 111.941 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -120.54 25.62 9.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.988 -0.551 . . . . 3.5499999999999998 111.107 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.44 ' HA ' ' CD1' ' B' ' 82' ' ' LEU . 0.0 OUTLIER -67.99 139.91 56.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.782 0.325 . . . . 1.8200000000000001 110.832 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.86 129.24 93.32 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 6.9000000000000004 110.899 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.02 164.91 33.32 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.493 2.129 . . . . 3.7000000000000002 112.258 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.406 -1.219 . . . . 5.4900000000000002 112.547 179.96 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' TRP . . . . . 0.419 ' CB ' ' HA ' ' B' ' 86' ' ' PRO . 2.3 p90 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.788 0.327 . . . . 1.9399999999999999 111.209 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' ARG . . . . . 0.405 ' O ' ' N ' ' B' ' 85' ' ' TYR . 0.0 OUTLIER -150.0 -167.5 2.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.348 -0.387 . . . . 2.4700000000000002 110.069 179.7 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.505 ' N ' ' CD1' ' B' ' 77' ' ' TYR . 0.5 OUTLIER -119.66 154.54 33.89 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.754 -0.379 . . . . 2.3700000000000001 110.644 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' TYR . . . . . 0.534 ' CE2' ' CD2' ' B' ' 85' ' ' TYR . 10.1 m-30 -98.12 162.65 13.1 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.116 -0.698 . . . . 2.29 109.116 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.08 -27.89 64.98 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.895 0.379 . . . . 2.1000000000000001 111.232 -179.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 5.7 p -67.31 -13.93 62.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.015 -0.539 . . . . 2.1899999999999999 112.3 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -156.03 179.85 8.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.111 0.482 . . . . 2.6499999999999999 112.059 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . 0.457 ' CD2' ' CG ' ' A' ' 68' ' ' HIS . 15.1 mt -115.6 5.3 14.32 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.68 -0.691 . . . . 1.97 111.177 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.94 159.45 57.34 Favored Pre-proline 0 C--N 1.332 -0.166 0 CA-C-O 120.804 0.335 . . . . 2.1400000000000001 111.261 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -70.69 143.17 45.63 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.949 2.432 . . . . 1.1299999999999999 111.342 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' TYR . . . . . 0.534 ' CD2' ' CE2' ' B' ' 78' ' ' TYR . 7.4 m-85 -134.93 104.63 10.6 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 116.255 -0.43 . . . . 2.1699999999999999 111.586 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . 0.419 ' HA ' ' CB ' ' B' ' 75' ' ' TRP . 75.0 Cg_endo -77.55 173.27 14.45 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.571 2.181 . . . . 1.8700000000000001 112.244 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' ASP . . . . . . . . . . . . . 31.0 p-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.29 -0.862 . . . . 3.0 110.946 -179.988 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.588 HG23 ' N ' ' A' ' 2' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.881 0.372 . . . . 1.14 111.027 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.781 HG13 ' O ' ' A' ' 14' ' ' VAL . 56.4 t -125.43 131.57 72.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.071 -0.513 . . . . 0.58 110.816 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.0 m -125.97 167.43 15.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.059 -0.518 . . . . 0.34 110.956 179.954 -59.999 -78.044 -69.422 103.854 2.031 104.092 -62.147 -40.825 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.463 ' ND1' ' HB2' ' A' ' 13' ' ' ALA . 78.8 m-70 -94.68 136.65 34.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.847 -0.615 . . . . 0.46 110.696 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.506 ' HA ' ' HB3' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -122.26 154.86 37.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.263 0.554 . . . . 0.51 111.237 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.975 HG22 HG22 ' A' ' 11' ' ' ILE . 2.2 p -131.09 19.15 4.95 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.206 -0.906 . . . . 0.62 110.909 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -80.31 -35.3 35.93 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.829 0.347 . . . . 1.08 111.583 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.435 ' OG1' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -69.83 -168.5 0.2 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.162 -0.472 . . . . 0.77 109.781 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.582 ' CB ' ' HD3' ' A' ' 10' ' ' PRO . 0.3 OUTLIER -69.24 -68.34 0.59 Allowed Pre-proline 0 N--CA 1.456 -0.168 0 N-CA-C 107.62 -1.252 . . . . 1.46 107.62 178.234 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.582 ' HD3' ' CB ' ' A' ' 9' ' ' SER . 93.5 Cg_endo -87.35 169.57 7.12 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 122.09 1.86 . . . . 0.85 109.636 176.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.975 HG22 HG22 ' A' ' 6' ' ' THR . 29.5 pt -90.37 131.62 37.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 C-N-CA 120.446 -0.502 . . . . 1.62 111.208 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -143.2 -175.13 4.41 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.911 -0.586 . . . . 0.75 110.676 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.463 ' HB2' ' ND1' ' A' ' 4' ' ' HIS . . . -138.69 133.88 32.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.308 -0.406 . . . . 0.64 111.068 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.781 ' O ' HG13 ' A' ' 2' ' ' VAL . 1.1 p -124.2 -174.22 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.102 -0.499 . . . . 1.21 110.998 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.762 ' H ' HG22 ' A' ' 14' ' ' VAL . 3.5 m -106.07 111.74 24.5 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.744 -0.662 . . . . 1.09 109.987 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 m -56.95 133.46 79.85 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.257 -0.429 . . . . 0.87 110.767 -179.742 -34.01 -149.523 100.267 104.154 2.029 103.941 150.793 -161.675 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.509 ' O ' ' N ' ' A' ' 19' ' ' GLY . 30.1 Cg_endo -63.78 175.48 2.95 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.527 2.151 . . . . 1.6 111.729 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HD2' ' CB ' ' A' ' 17' ' ' PRO . 20.3 Cg_endo -60.86 68.95 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.353 2.035 . . . . 2.5 111.903 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.509 ' N ' ' O ' ' A' ' 17' ' ' PRO . . . -164.61 -41.09 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.837 -0.62 . . . . 1.36 112.342 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -114.85 136.67 52.83 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.254 0.549 . . . . 2.3 110.803 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -123.18 -18.83 6.2 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.389 -0.823 . . . . 1.17 110.948 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.744 HD23 ' HA ' ' A' ' 61' ' ' SER . 7.6 mt -105.58 161.43 14.37 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 116.291 -0.413 . . . . 1.21 111.306 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.419 ' O ' ' HA ' ' A' ' 59' ' ' CYS . 4.3 m -112.55 169.4 8.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.862 -0.608 . . . . 0.45 109.912 179.314 -40.825 -62.147 -69.422 104.092 2.031 103.854 -78.044 -59.999 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.465 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 1.1 p90 -145.24 146.36 31.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.302 0.572 . . . . 0.92 112.013 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.424 ' HG3' ' CD1' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -135.24 109.85 8.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.039 -0.982 . . . . 2.62 109.543 179.182 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.495 ' HB3' ' CB ' ' A' ' 41' ' ' GLU . 6.8 tttp -89.88 146.52 24.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.94 0.4 . . . . 2.29 111.431 -179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.584 ' HA ' ' O ' ' A' ' 39' ' ' VAL . 0.2 OUTLIER -147.55 132.63 18.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.893 -0.594 . . . . 1.8 111.667 179.856 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.877 ' O ' HG23 ' A' ' 39' ' ' VAL . 0.5 OUTLIER -170.58 121.22 0.59 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.421 -0.809 . . . . 1.54 109.788 179.167 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.775 ' HA ' ' N ' ' A' ' 38' ' ' LYS . 79.0 m -54.97 113.21 1.26 Allowed 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 113.901 1.075 . . . . 0.74 113.901 -176.902 -63.867 -162.406 23.528 105.439 2.043 106.329 73.536 -159.079 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.927 ' O ' ' N ' ' A' ' 32' ' ' PHE . 1.9 p30 -73.58 145.37 45.52 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 105.008 -2.219 . . . . 1.56 105.008 174.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.437 ' O ' ' HD1' ' A' ' 32' ' ' PHE . . . -36.15 56.57 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.941 1.089 . . . . 1.29 113.941 -175.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.927 ' N ' ' O ' ' A' ' 30' ' ' ASP . 0.1 OUTLIER -172.92 29.12 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.261 -0.882 . . . . 1.91 110.345 177.582 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.705 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 5.7 t -41.2 -24.93 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 111.599 0.222 . . . . 1.08 111.599 -179.716 -159.079 73.536 23.528 106.329 2.043 105.439 -162.406 -63.867 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -77.23 -48.72 16.8 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.897 0.38 . . . . 1.93 110.011 178.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.475 ' HB2' ' CD2' ' A' ' 32' ' ' PHE . 0.8 OUTLIER -97.1 -79.66 0.45 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.079 -0.509 . . . . 1.58 110.016 179.128 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.646 ' H ' ' HB3' ' A' ' 32' ' ' PHE . 4.7 mmt85 -69.06 -82.54 0.03 OUTLIER 'General case' 0 C--O 1.232 0.166 0 N-CA-C 108.271 -1.011 . . . . 3.28 108.271 178.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.762 ' C ' ' HA ' ' A' ' 29' ' ' CYS . . . 84.15 -146.84 23.14 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 119.007 -1.568 . . . . 0.7 115.611 176.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.775 ' N ' ' HA ' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -39.56 107.03 0.06 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 113.572 0.953 . . . . 2.26 113.572 -175.933 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 28' ' ' TRP . 2.2 t -71.03 134.13 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 107.69 -1.226 . . . . 0.91 107.69 177.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.781 HG11 ' CD2' ' A' ' 68' ' ' HIS . 6.4 t -105.31 121.46 57.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.153 0.502 . . . . 0.51 111.921 -178.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.495 ' CB ' ' HB3' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -114.7 155.03 27.38 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.324 -0.853 . . . . 2.0 109.545 178.806 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.506 ' HB3' ' HA ' ' A' ' 5' ' ' THR . 0.8 OUTLIER -141.66 139.3 32.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.815 0.34 . . . . 1.2 111.376 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.464 ' HA3' ' CE2' ' A' ' 24' ' ' TYR . . . 177.23 166.32 33.89 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.525 -0.845 . . . . 0.49 112.812 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 7.8 t -95.13 162.09 13.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.751 0.31 . . . . 1.05 110.791 179.985 -161.675 150.793 100.267 103.941 2.029 104.154 -149.523 -34.01 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -162.02 151.57 16.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.349 -0.387 . . . . 0.87 111.143 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.651 ' O ' HD12 ' A' ' 22' ' ' LEU . . . -78.96 -37.94 38.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 0.91 111.108 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.34 176.44 8.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 1.81 110.928 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.3 t -102.9 92.8 3.83 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 1.97 110.878 179.817 -158.309 51.505 69.576 103.97 2.03 103.845 108.872 -20.545 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -68.05 -179.38 2.14 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.568 2.179 . . . . 2.2 112.402 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.6 m -58.95 -174.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 3.4 110.98 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -169.76 135.66 1.5 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 6.2 111.13 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.1 mttm -81.23 152.63 71.09 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 5.5 110.896 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -48.13 -30.52 14.57 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.642 2.228 . . . . 3.9 112.432 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -91.88 -75.71 0.47 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 5.84 111.025 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.445 ' CG ' ' CE3' ' A' ' 28' ' ' TRP . 30.0 mt-10 -73.29 83.52 1.39 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.122 -0.49 . . . . 3.33 110.718 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -100.68 153.8 19.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 4.0 111.049 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.451 ' CG1' ' HB2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -135.94 124.09 36.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.89 -0.596 . . . . 1.51 110.808 179.937 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.8 p -93.32 115.62 28.19 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.961 0.41 . . . . 1.41 110.637 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -101.33 138.33 38.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.978 -0.555 . . . . 1.39 110.689 -179.745 -20.545 108.872 69.576 103.845 2.03 103.97 51.505 -158.309 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.1 p -130.46 162.86 28.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.443 -0.344 . . . . 1.24 110.879 179.946 35.261 100.852 80.899 103.709 2.028 103.782 94.754 69.861 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.744 ' HA ' HD23 ' A' ' 22' ' ' LEU . 25.7 p -114.92 55.63 0.75 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.326 -0.397 . . . . 1.03 111.338 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.441 HG22 ' N ' ' A' ' 63' ' ' ASP . 30.6 m -153.84 163.02 40.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.362 -0.381 . . . . 1.73 110.78 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.441 ' N ' HG22 ' A' ' 62' ' ' THR . 5.7 t70 -71.58 151.85 43.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.513 -0.312 . . . . 1.67 110.506 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.448 ' HA ' ' NE2' ' A' ' 4' ' ' HIS . 3.5 ptmt 34.9 41.43 0.06 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.018 -0.537 . . . . 2.89 111.032 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.546 ' C ' ' HD3' ' A' ' 67' ' ' PRO . 20.2 p -90.92 -12.28 36.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.727 -0.67 . . . . 1.08 112.656 -178.598 69.861 94.754 80.899 103.782 2.028 103.709 100.852 35.261 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.497 ' O ' HD11 ' A' ' 42' ' ' LEU . 17.3 p-10 -113.23 57.89 0.65 Allowed Pre-proline 0 N--CA 1.453 -0.322 0 N-CA-C 112.513 0.56 . . . . 0.52 112.513 -178.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.546 ' HD3' ' C ' ' A' ' 65' ' ' CYS . 69.0 Cg_endo -84.29 160.07 13.1 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.676 2.25 . . . . 0.65 112.07 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.781 ' CD2' HG11 ' A' ' 40' ' ' VAL . 9.9 t-80 -57.4 134.26 81.63 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.401 -0.363 . . . . 0.47 110.594 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -55.45 -26.56 54.4 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.203 1.935 . . . . 0.93 111.941 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -120.54 25.62 9.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.988 -0.551 . . . . 3.09 111.107 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.898 ' HA ' HD11 ' B' ' 82' ' ' LEU . 0.0 OUTLIER -67.99 139.91 56.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.782 0.325 . . . . 1.82 110.832 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.86 129.24 93.32 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 6.19 110.899 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.02 164.91 33.32 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.493 2.129 . . . . 3.17 112.258 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.406 -1.219 . . . . 5.49 112.547 179.96 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 75' ' ' TRP . . . . . . . . . . . . . 2.3 p90 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.788 0.327 . . . . 1.64 111.209 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 76' ' ' ARG . . . . . 0.517 ' HG3' HG12 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -150.0 -167.5 2.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.348 -0.387 . . . . 2.0 110.069 179.7 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.653 ' CZ ' HG23 ' A' ' 11' ' ' ILE . 0.5 OUTLIER -119.66 154.54 33.89 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.754 -0.379 . . . . 1.52 110.644 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 78' ' ' TYR . . . . . 0.534 ' CE2' ' CD2' ' B' ' 85' ' ' TYR . 10.1 m-30 -98.12 162.65 13.1 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.116 -0.698 . . . . 1.47 109.116 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 79' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 38' ' ' LYS . 34.5 tt0 -70.08 -27.89 64.98 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.895 0.379 . . . . 2.1 111.232 -179.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 5.7 p -67.31 -13.93 62.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.015 -0.539 . . . . 1.79 112.3 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -156.03 179.85 8.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.111 0.482 . . . . 2.25 112.059 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.898 HD11 ' HA ' ' A' ' 71' ' ' GLN . 15.1 mt -115.6 5.3 14.32 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.68 -0.691 . . . . 1.42 111.177 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.94 159.45 57.34 Favored Pre-proline 0 C--N 1.332 -0.166 0 CA-C-O 120.804 0.335 . . . . 2.14 111.261 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -70.69 143.17 45.63 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.949 2.432 . . . . 0.89 111.342 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' TYR . . . . . 0.534 ' CD2' ' CE2' ' B' ' 78' ' ' TYR . 7.4 m-85 -134.93 104.63 10.6 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 116.255 -0.43 . . . . 1.32 111.586 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -77.55 173.27 14.45 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.571 2.181 . . . . 1.66 112.244 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' ASP . . . . . . . . . . . . . 31.0 p-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.29 -0.862 . . . . 3.0 110.946 -179.988 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.588 HG23 ' N ' ' A' ' 2' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.881 0.372 . . . . 1.14 111.027 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.781 HG13 ' O ' ' A' ' 14' ' ' VAL . 56.4 t -125.43 131.57 72.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.071 -0.513 . . . . 0.58 110.816 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.0 m -125.97 167.43 15.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.059 -0.518 . . . . 0.34 110.956 179.954 -59.999 -78.044 -69.422 103.854 2.031 104.092 -62.147 -40.825 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.463 ' ND1' ' HB2' ' A' ' 13' ' ' ALA . 78.8 m-70 -94.68 136.65 34.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.847 -0.615 . . . . 0.46 110.696 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.506 ' HA ' ' HB3' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -122.26 154.86 37.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.263 0.554 . . . . 0.51 111.237 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.975 HG22 HG22 ' A' ' 11' ' ' ILE . 2.2 p -131.09 19.15 4.95 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.206 -0.906 . . . . 0.62 110.909 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -80.31 -35.3 35.93 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.829 0.347 . . . . 1.08 111.583 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.435 ' OG1' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -69.83 -168.5 0.2 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.162 -0.472 . . . . 0.77 109.781 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.582 ' CB ' ' HD3' ' A' ' 10' ' ' PRO . 0.3 OUTLIER -69.24 -68.34 0.59 Allowed Pre-proline 0 N--CA 1.456 -0.168 0 N-CA-C 107.62 -1.252 . . . . 1.46 107.62 178.234 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.582 ' HD3' ' CB ' ' A' ' 9' ' ' SER . 93.5 Cg_endo -87.35 169.57 7.12 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 122.09 1.86 . . . . 0.85 109.636 176.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.975 HG22 HG22 ' A' ' 6' ' ' THR . 29.5 pt -90.37 131.62 37.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 C-N-CA 120.446 -0.502 . . . . 1.62 111.208 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -143.2 -175.13 4.41 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.911 -0.586 . . . . 0.75 110.676 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.463 ' HB2' ' ND1' ' A' ' 4' ' ' HIS . . . -138.69 133.88 32.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.308 -0.406 . . . . 0.64 111.068 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.781 ' O ' HG13 ' A' ' 2' ' ' VAL . 1.1 p -124.2 -174.22 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.102 -0.499 . . . . 1.21 110.998 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.762 ' H ' HG22 ' A' ' 14' ' ' VAL . 3.5 m -106.07 111.74 24.5 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.744 -0.662 . . . . 1.09 109.987 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 m -56.95 133.46 79.85 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.257 -0.429 . . . . 0.87 110.767 -179.742 -34.01 -149.523 100.267 104.154 2.029 103.941 150.793 -161.675 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.509 ' O ' ' N ' ' A' ' 19' ' ' GLY . 30.1 Cg_endo -63.78 175.48 2.95 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.527 2.151 . . . . 1.6 111.729 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HD2' ' CB ' ' A' ' 17' ' ' PRO . 20.3 Cg_endo -60.86 68.95 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.353 2.035 . . . . 2.5 111.903 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.509 ' N ' ' O ' ' A' ' 17' ' ' PRO . . . -164.61 -41.09 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.837 -0.62 . . . . 1.36 112.342 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -114.85 136.67 52.83 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.254 0.549 . . . . 2.3 110.803 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -123.18 -18.83 6.2 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.389 -0.823 . . . . 1.17 110.948 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.744 HD23 ' HA ' ' A' ' 61' ' ' SER . 7.6 mt -105.58 161.43 14.37 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 116.291 -0.413 . . . . 1.21 111.306 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.419 ' O ' ' HA ' ' A' ' 59' ' ' CYS . 4.3 m -112.55 169.4 8.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.862 -0.608 . . . . 0.45 109.912 179.314 -40.825 -62.147 -69.422 104.092 2.031 103.854 -78.044 -59.999 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.465 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 1.1 p90 -145.24 146.36 31.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.302 0.572 . . . . 0.92 112.013 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.424 ' HG3' ' CD1' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -135.24 109.85 8.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.039 -0.982 . . . . 2.62 109.543 179.182 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.495 ' HB3' ' CB ' ' A' ' 41' ' ' GLU . 6.8 tttp -89.88 146.52 24.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.94 0.4 . . . . 2.29 111.431 -179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.584 ' HA ' ' O ' ' A' ' 39' ' ' VAL . 0.2 OUTLIER -147.55 132.63 18.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.893 -0.594 . . . . 1.8 111.667 179.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.877 ' O ' HG23 ' A' ' 39' ' ' VAL . 0.5 OUTLIER -170.58 121.22 0.59 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.421 -0.809 . . . . 1.54 109.788 179.167 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.775 ' HA ' ' N ' ' A' ' 38' ' ' LYS . 79.0 m -54.97 113.21 1.26 Allowed 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 113.901 1.075 . . . . 0.74 113.901 -176.902 -63.867 -162.406 23.528 105.439 2.043 106.329 73.536 -159.079 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.927 ' O ' ' N ' ' A' ' 32' ' ' PHE . 1.9 p30 -73.58 145.37 45.52 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 105.008 -2.219 . . . . 1.56 105.008 174.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.437 ' O ' ' HD1' ' A' ' 32' ' ' PHE . . . -36.15 56.57 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.941 1.089 . . . . 1.29 113.941 -175.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.927 ' N ' ' O ' ' A' ' 30' ' ' ASP . 0.1 OUTLIER -172.92 29.12 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.261 -0.882 . . . . 1.91 110.345 177.582 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.705 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 5.7 t -41.2 -24.93 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 111.599 0.222 . . . . 1.08 111.599 -179.716 -159.079 73.536 23.528 106.329 2.043 105.439 -162.406 -63.867 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -77.23 -48.72 16.8 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.897 0.38 . . . . 1.93 110.011 178.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.475 ' HB2' ' CD2' ' A' ' 32' ' ' PHE . 0.8 OUTLIER -97.1 -79.66 0.45 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.079 -0.509 . . . . 1.58 110.016 179.128 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.646 ' H ' ' HB3' ' A' ' 32' ' ' PHE . 4.7 mmt85 -69.06 -82.54 0.03 OUTLIER 'General case' 0 C--O 1.232 0.166 0 N-CA-C 108.271 -1.011 . . . . 3.28 108.271 178.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.762 ' C ' ' HA ' ' A' ' 29' ' ' CYS . . . 84.15 -146.84 23.14 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 119.007 -1.568 . . . . 0.7 115.611 176.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.775 ' N ' ' HA ' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -39.56 107.03 0.06 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 113.572 0.953 . . . . 2.26 113.572 -175.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 28' ' ' TRP . 2.2 t -71.03 134.13 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 107.69 -1.226 . . . . 0.91 107.69 177.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.781 HG11 ' CD2' ' A' ' 68' ' ' HIS . 6.4 t -105.31 121.46 57.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.153 0.502 . . . . 0.51 111.921 -178.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.495 ' CB ' ' HB3' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -114.7 155.03 27.38 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.324 -0.853 . . . . 2.0 109.545 178.806 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.506 ' HB3' ' HA ' ' A' ' 5' ' ' THR . 0.8 OUTLIER -141.66 139.3 32.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.815 0.34 . . . . 1.2 111.376 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.464 ' HA3' ' CE2' ' A' ' 24' ' ' TYR . . . 177.23 166.32 33.89 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.525 -0.845 . . . . 0.49 112.812 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 7.8 t -95.13 162.09 13.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.751 0.31 . . . . 1.05 110.791 179.985 -161.675 150.793 100.267 103.941 2.029 104.154 -149.523 -34.01 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -162.02 151.57 16.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.349 -0.387 . . . . 0.87 111.143 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.651 ' O ' HD12 ' A' ' 22' ' ' LEU . . . -78.96 -37.94 38.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 0.91 111.108 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.34 176.44 8.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 1.81 110.928 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.3 t -102.9 92.8 3.83 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 1.97 110.878 179.817 -158.309 51.505 69.576 103.97 2.03 103.845 108.872 -20.545 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -68.05 -179.38 2.14 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.568 2.179 . . . . 2.2 112.402 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.6 m -58.95 -174.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 3.4 110.98 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -169.76 135.66 1.5 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 6.2 111.13 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.1 mttm -81.23 152.63 71.09 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 5.5 110.896 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -48.13 -30.52 14.57 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.642 2.228 . . . . 3.9 112.432 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -91.88 -75.71 0.47 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 5.84 111.025 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.445 ' CG ' ' CE3' ' A' ' 28' ' ' TRP . 30.0 mt-10 -73.29 83.52 1.39 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.122 -0.49 . . . . 3.33 110.718 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -100.68 153.8 19.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 4.0 111.049 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.451 ' CG1' ' HB2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -135.94 124.09 36.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.89 -0.596 . . . . 1.51 110.808 179.937 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.8 p -93.32 115.62 28.19 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.961 0.41 . . . . 1.41 110.637 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -101.33 138.33 38.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.978 -0.555 . . . . 1.39 110.689 -179.745 -20.545 108.872 69.576 103.845 2.03 103.97 51.505 -158.309 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.1 p -130.46 162.86 28.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.443 -0.344 . . . . 1.24 110.879 179.946 35.261 100.852 80.899 103.709 2.028 103.782 94.754 69.861 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.744 ' HA ' HD23 ' A' ' 22' ' ' LEU . 25.7 p -114.92 55.63 0.75 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.326 -0.397 . . . . 1.03 111.338 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.441 HG22 ' N ' ' A' ' 63' ' ' ASP . 30.6 m -153.84 163.02 40.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.362 -0.381 . . . . 1.73 110.78 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.441 ' N ' HG22 ' A' ' 62' ' ' THR . 5.7 t70 -71.58 151.85 43.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.513 -0.312 . . . . 1.67 110.506 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.448 ' HA ' ' NE2' ' A' ' 4' ' ' HIS . 3.5 ptmt 34.9 41.43 0.06 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.018 -0.537 . . . . 2.89 111.032 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.546 ' C ' ' HD3' ' A' ' 67' ' ' PRO . 20.2 p -90.92 -12.28 36.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.727 -0.67 . . . . 1.08 112.656 -178.598 69.861 94.754 80.899 103.782 2.028 103.709 100.852 35.261 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.497 ' O ' HD11 ' A' ' 42' ' ' LEU . 17.3 p-10 -113.23 57.89 0.65 Allowed Pre-proline 0 N--CA 1.453 -0.322 0 N-CA-C 112.513 0.56 . . . . 0.52 112.513 -178.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.546 ' HD3' ' C ' ' A' ' 65' ' ' CYS . 69.0 Cg_endo -84.29 160.07 13.1 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.676 2.25 . . . . 0.65 112.07 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.781 ' CD2' HG11 ' A' ' 40' ' ' VAL . 9.9 t-80 -57.4 134.26 81.63 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.401 -0.363 . . . . 0.47 110.594 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -55.45 -26.56 54.4 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.203 1.935 . . . . 0.93 111.941 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -120.54 25.62 9.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.988 -0.551 . . . . 3.09 111.107 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.898 ' HA ' HD11 ' B' ' 82' ' ' LEU . 0.0 OUTLIER -67.99 139.91 56.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.782 0.325 . . . . 1.82 110.832 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.86 129.24 93.32 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 6.19 110.899 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.02 164.91 33.32 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.493 2.129 . . . . 3.17 112.258 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.406 -1.219 . . . . 5.49 112.547 179.96 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' TRP . . . . . . . . . . . . . 2.3 p90 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.788 0.327 . . . . 1.64 111.209 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' ARG . . . . . 0.517 ' HG3' HG12 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -150.0 -167.5 2.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.348 -0.387 . . . . 2.0 110.069 179.7 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.653 ' CZ ' HG23 ' A' ' 11' ' ' ILE . 0.5 OUTLIER -119.66 154.54 33.89 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.754 -0.379 . . . . 1.52 110.644 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' TYR . . . . . 0.534 ' CE2' ' CD2' ' B' ' 85' ' ' TYR . 10.1 m-30 -98.12 162.65 13.1 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.116 -0.698 . . . . 1.47 109.116 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 38' ' ' LYS . 34.5 tt0 -70.08 -27.89 64.98 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.895 0.379 . . . . 2.1 111.232 -179.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 5.7 p -67.31 -13.93 62.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.015 -0.539 . . . . 1.79 112.3 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -156.03 179.85 8.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.111 0.482 . . . . 2.25 112.059 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.898 HD11 ' HA ' ' A' ' 71' ' ' GLN . 15.1 mt -115.6 5.3 14.32 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.68 -0.691 . . . . 1.42 111.177 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.94 159.45 57.34 Favored Pre-proline 0 C--N 1.332 -0.166 0 CA-C-O 120.804 0.335 . . . . 2.14 111.261 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -70.69 143.17 45.63 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.949 2.432 . . . . 0.89 111.342 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' TYR . . . . . 0.534 ' CD2' ' CE2' ' B' ' 78' ' ' TYR . 7.4 m-85 -134.93 104.63 10.6 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 116.255 -0.43 . . . . 1.32 111.586 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -77.55 173.27 14.45 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.571 2.181 . . . . 1.66 112.244 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' ASP . . . . . . . . . . . . . 31.0 p-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.29 -0.862 . . . . 3.0 110.946 -179.988 . . . . . . . . 0 0 . 1 stop_ save_